ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline

C253H240N18O30 — CID 157125365

IUPACethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline
SMILESC.C.C.C.C.C.C.C.C.C(=C/c1cccc(-c2nn[nH]n2)c1)\c1ccc(OCc2ccc3ccccc3n2)cc1.CC(Oc1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1)C(=O)O.CC(Oc1ccccc1COc1ccc(/C=C/c2ccc3ccccc3n2)cc1)C(=O)O.CCOC(=O)c1cc(=O)c2ccc(OCc3cccc(OCc4ccc5ccccc5n4)c3)cc2o1.NC(=O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C(O)/C=C/c1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1.O=C(O)COc1ccccc1COc1cccc(OCc2ccc3ccccc3n2)c1.O=C(O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C1c2cc(OCc3ccc4ccccc4n3)ccc2CCC1Cc1cccc(-c2nn[nH]n2)c1
InChIInChI=1S/C29H23NO6.C28H23N5O2.C28H26N2O2.C28H25NO3.2C27H23NO4.C27H21NO3.C25H19N5O.C25H21NO5.9CH4/c1-2-33-29(32)28-16-26(31)24-13-12-23(15-27(24)36-28)34-17-19-6-5-8-22(14-19)35-18-21-11-10-20-7-3-4-9-25(20)30-21;34-27-21(14-18-4-3-6-22(15-18)28-30-32-33-31-28)9-8-19-11-13-24(16-25(19)27)35-17-23-12-10-20-5-1-2-7-26(20)29-23;29-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)30-25;30-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)29-25;1-19(27(29)30)32-26-9-5-3-7-22(26)18-31-24-16-11-20(12-17-24)10-14-23-15-13-21-6-2-4-8-25(21)28-23;1-19(27(29)30)32-26-9-5-3-7-22(26)13-10-20-11-16-24(17-12-20)31-18-23-15-14-21-6-2-4-8-25(21)28-23;29-27(30)18-14-22-6-2-1-5-21(22)12-9-20-10-16-25(17-11-20)31-19-24-15-13-23-7-3-4-8-26(23)28-24;1-2-7-24-20(5-1)12-13-22(26-24)17-31-23-14-10-18(11-15-23)8-9-19-4-3-6-21(16-19)25-27-29-30-28-25;27-25(28)17-31-24-11-4-2-7-19(24)15-29-21-8-5-9-22(14-21)30-16-20-13-12-18-6-1-3-10-23(18)26-20;;;;;;;;;/h3-16H,2,17-18H2,1H3;1-7,10-13,15-16,21H,8-9,14,17H2,(H,30,31,32,33);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H2,29,31);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H,30,31);2*2-17,19H,18H2,1H3,(H,29,30);1-18H,19H2,(H,29,30);1-16H,17H2,(H,27,28,29,30);1-14H,15-17H2,(H,27,28);9*1H4/b;;;;14-10+;13-10+;12-9+,18-14+;9-8+;;;;;;;;;;
InChIKeyAILGSHZNTOPLSM-RVDANLQUSA-N
MW4012.80 g/mol
LogP55.28
Rot. Bonds64

About ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline

ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline (PubChem CID 157125365) has the molecular formula C253H240N18O30 and a molecular weight of 4012.80 g/mol. Its IUPAC name is ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline.

Molecular Properties

Compound Nameethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline
PubChem CID157125365
Molecular FormulaC253H240N18O30
Molecular Weight4012.80 g/mol
Exact Mass4009.78
IUPAC Nameethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline
SMILESC.C.C.C.C.C.C.C.C.C(=C/c1cccc(-c2nn[nH]n2)c1)\c1ccc(OCc2ccc3ccccc3n2)cc1.CC(Oc1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1)C(=O)O.CC(Oc1ccccc1COc1ccc(/C=C/c2ccc3ccccc3n2)cc1)C(=O)O.CCOC(=O)c1cc(=O)c2ccc(OCc3cccc(OCc4ccc5ccccc5n4)c3)cc2o1.NC(=O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C(O)/C=C/c1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1.O=C(O)COc1ccccc1COc1cccc(OCc2ccc3ccccc3n2)c1.O=C(O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C1c2cc(OCc3ccc4ccccc4n3)ccc2CCC1Cc1cccc(-c2nn[nH]n2)c1
InChIInChI=1S/C29H23NO6.C28H23N5O2.C28H26N2O2.C28H25NO3.2C27H23NO4.C27H21NO3.C25H19N5O.C25H21NO5.9CH4/c1-2-33-29(32)28-16-26(31)24-13-12-23(15-27(24)36-28)34-17-19-6-5-8-22(14-19)35-18-21-11-10-20-7-3-4-9-25(20)30-21;34-27-21(14-18-4-3-6-22(15-18)28-30-32-33-31-28)9-8-19-11-13-24(16-25(19)27)35-17-23-12-10-20-5-1-2-7-26(20)29-23;29-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)30-25;30-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)29-25;1-19(27(29)30)32-26-9-5-3-7-22(26)18-31-24-16-11-20(12-17-24)10-14-23-15-13-21-6-2-4-8-25(21)28-23;1-19(27(29)30)32-26-9-5-3-7-22(26)13-10-20-11-16-24(17-12-20)31-18-23-15-14-21-6-2-4-8-25(21)28-23;29-27(30)18-14-22-6-2-1-5-21(22)12-9-20-10-16-25(17-11-20)31-19-24-15-13-23-7-3-4-8-26(23)28-24;1-2-7-24-20(5-1)12-13-22(26-24)17-31-23-14-10-18(11-15-23)8-9-19-4-3-6-21(16-19)25-27-29-30-28-25;27-25(28)17-31-24-11-4-2-7-19(24)15-29-21-8-5-9-22(14-21)30-16-20-13-12-18-6-1-3-10-23(18)26-20;;;;;;;;;/h3-16H,2,17-18H2,1H3;1-7,10-13,15-16,21H,8-9,14,17H2,(H,30,31,32,33);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H2,29,31);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H,30,31);2*2-17,19H,18H2,1H3,(H,29,30);1-18H,19H2,(H,29,30);1-16H,17H2,(H,27,28,29,30);1-14H,15-17H2,(H,27,28);9*1H4/b;;;;14-10+;13-10+;12-9+,18-14+;9-8+;;;;;;;;;;
InChIKeyAILGSHZNTOPLSM-RVDANLQUSA-N
XLogP55.28
TPSA657.32 Ų
H-Bond Donors8
H-Bond Acceptors40
Rotatable Bonds64
Heavy Atoms301
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004012.80
LogP ≤ 555.28
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline with MolForge

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Launch Full Analysis

Related Compounds

methyl 4-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]-3-(2H-tetrazol-5-ylmethoxy)benzoate;2-[[3-[[2-(2H-tetrazol-5-ylmethoxy)phenyl]methoxy]phenoxy]methyl]quinoline
CID 88401732
2-[[3-[[2-methoxy-4-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenoxy]methyl]quinoline;2-[[3-[[3-methoxy-4-(2H-tetrazol-5-yl)phenoxy]methyl]phenoxy]methyl]quinoline;methyl 2-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]-5-(2H-tetrazol-5-yl)benzoate
CID 88626042
1-[4-chloro-2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]propan-2-one;2-[[3-[(2-ethylphenyl)methoxy]phenoxy]methyl]quinoline;2-[2-[[4-[(8-fluoroquinolin-2-yl)methoxy]phenoxy]methyl]-6-methylphenoxy]pentanoic acid;2-[[3-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl]methyl]pentanoic acid;2-[[4-[(E)-2-[2-(2H-tetrazol-5-ylmethyl)phenyl]ethenyl]phenoxy]methyl]quinoline
CID 91060400
ethane;2-methyl-5-[4-(quinolin-2-ylmethoxy)phenyl]furan-3-carboxylic acid;propane;2-[[7-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalen-2-yl]oxymethyl]quinoline
CID 142024425
ethane;N-hydrazinylidene-3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzenecarboximidamide;2-methyl-5-[4-(quinolin-2-ylmethoxy)phenyl]furan-3-carboxylic acid;prop-1-ene
CID 142024490
2-[6-acetyl-2-propyl-3-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]phenoxy]acetic acid;5-[[2-[[4-[(E)-2-naphthalen-2-ylethenyl]phenoxy]methyl]phenyl]methyl]-2H-tetrazole;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;(E)-3-[2-[2-[4-(quinolin-2-ylmethoxy)phenyl]ethyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline
CID 157253431
2-[6-acetyl-2-propyl-3-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]phenoxy]acetic acid;methane;(E)-3-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenyl]prop-2-enoic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;2-[(E)-2-[4-[[2-(2H-tetrazol-5-ylmethyl)phenyl]methoxy]phenyl]ethenyl]quinoline
CID 157473275
ethyl 4-[3-(quinolin-2-ylmethoxy)phenoxy]butanoate;ethyl 4-[4-(quinolin-2-ylmethoxy)phenoxy]butanoate;2-[[3-methyl-5-[3-(2H-tetrazol-5-yl)propoxy]phenoxy]methyl]quinoline;5-[3-[3-(naphthalen-2-ylmethoxy)phenoxy]propyl]-2H-tetrazole;5-[3-(3-phenylmethoxyphenoxy)propyl]-2H-tetrazole;4-[3-(quinolin-2-ylmethoxy)phenoxy]butanoic acid;2-[[4-[(E)-2-(2H-tetrazol-5-yl)ethenyl]phenoxy]methyl]quinoline;hydrochloride
CID 157596621
methane;2-[2-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl]acetic acid;1-[3-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl]ethanone;2-[[4-[[3-(2H-tetrazol-5-yl)phenyl]methoxy]phenoxy]methyl]quinoline
CID 157776014
methane;methyl 4-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]-3-(2H-tetrazol-5-ylmethoxy)benzoate;2-[[4-[[4-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenoxy]methyl]quinoline;2-[[3-[[3-(2H-tetrazol-5-yl)phenoxy]methyl]phenoxy]methyl]quinoline;2-[[3-[[4-(2H-tetrazol-5-yl)phenyl]methoxy]phenoxy]methyl]quinoline
CID 157912945
methane;N-methyl-2-[3-(5-oxohexyl)-5-phenylmethoxynaphthalen-1-yl]-N-(2-phenylethyl)acetamide;3-[4-[2-[methyl(2-phenylethyl)amino]-2-oxoethyl]-8-phenylnaphthalen-2-yl]propanoic acid;5-methyl-6-[3-(quinolin-2-ylmethoxy)phenyl]hexan-2-one;2-[[4-[2-methyl-4-(1H-1,2,4-triazol-5-yl)butyl]phenoxy]methyl]quinoline;5-[[5-(quinolin-2-ylmethoxymethyl)furan-2-yl]methoxy]pentan-2-one;6-[3-(quinolin-2-ylmethoxy)phenyl]hexanoic acid
CID 158305391
2-[2-[(E)-2-[4-[(7-chloroquinolin-3-yl)oxymethyl]phenyl]ethenyl]phenoxy]pentanoic acid;2-[[2-[[3-[(8-fluoroquinolin-2-yl)methoxy]phenoxy]methyl]phenyl]methyl]pentanoic acid;methane;2-methoxy-6-methyl-4-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]benzoic acid;2-methyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid;2-[3-[[4-[(E)-2-phenylethenyl]phenyl]methoxy]phenyl]acetic acid;7-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]-1-benzofuran-2-carboxylic acid;2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]benzoic acid;(E)-3-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenyl]prop-2-enoic acid;2-[2-[(Z)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]pentanoic acid;2-[[4-[(E)-2-[2-(2H-tetrazol-5-ylmethyl)phenyl]ethenyl]phenoxy]methyl]quinoline
CID 158441723

Frequently Asked Questions

What is the IUPAC name of ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline?
The IUPAC name of ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline (CID 157125365) is ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline.
What is the SMILES notation for ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline?
The canonical SMILES for ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline is C.C.C.C.C.C.C.C.C.C(=C/c1cccc(-c2nn[nH]n2)c1)\c1ccc(OCc2ccc3ccccc3n2)cc1.CC(Oc1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1)C(=O)O.CC(Oc1ccccc1COc1ccc(/C=C/c2ccc3ccccc3n2)cc1)C(=O)O.CCOC(=O)c1cc(=O)c2ccc(OCc3cccc(OCc4ccc5ccccc5n4)c3)cc2o1.NC(=O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C(O)/C=C/c1ccccc1/C=C/c1ccc(OCc2ccc3ccccc3n2)cc1.O=C(O)COc1ccccc1COc1cccc(OCc2ccc3ccccc3n2)c1.O=C(O)c1cccc(CC2CCc3ccc(OCc4ccc5ccccc5n4)cc3C2)c1.O=C1c2cc(OCc3ccc4ccccc4n3)ccc2CCC1Cc1cccc(-c2nn[nH]n2)c1.
What is the InChIKey of ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline?
The InChIKey is AILGSHZNTOPLSM-RVDANLQUSA-N. The full InChI is InChI=1S/C29H23NO6.C28H23N5O2.C28H26N2O2.C28H25NO3.2C27H23NO4.C27H21NO3.C25H19N5O.C25H21NO5.9CH4/c1-2-33-29(32)28-16-26(31)24-13-12-23(15-27(24)36-28)34-17-19-6-5-8-22(14-19)35-18-21-11-10-20-7-3-4-9-25(20)30-21;34-27-21(14-18-4-3-6-22(15-18)28-30-32-33-31-28)9-8-19-11-13-24(16-25(19)27)35-17-23-12-10-20-5-1-2-7-26(20)29-23;29-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)30-25;30-28(31)23-6-3-4-19(15-23)14-20-8-9-21-11-13-26(17-24(21)16-20)32-18-25-12-10-22-5-1-2-7-27(22)29-25;1-19(27(29)30)32-26-9-5-3-7-22(26)18-31-24-16-11-20(12-17-24)10-14-23-15-13-21-6-2-4-8-25(21)28-23;1-19(27(29)30)32-26-9-5-3-7-22(26)13-10-20-11-16-24(17-12-20)31-18-23-15-14-21-6-2-4-8-25(21)28-23;29-27(30)18-14-22-6-2-1-5-21(22)12-9-20-10-16-25(17-11-20)31-19-24-15-13-23-7-3-4-8-26(23)28-24;1-2-7-24-20(5-1)12-13-22(26-24)17-31-23-14-10-18(11-15-23)8-9-19-4-3-6-21(16-19)25-27-29-30-28-25;27-25(28)17-31-24-11-4-2-7-19(24)15-29-21-8-5-9-22(14-21)30-16-20-13-12-18-6-1-3-10-23(18)26-20;;;;;;;;;/h3-16H,2,17-18H2,1H3;1-7,10-13,15-16,21H,8-9,14,17H2,(H,30,31,32,33);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H2,29,31);1-7,10-13,15,17,20H,8-9,14,16,18H2,(H,30,31);2*2-17,19H,18H2,1H3,(H,29,30);1-18H,19H2,(H,29,30);1-16H,17H2,(H,27,28,29,30);1-14H,15-17H2,(H,27,28);9*1H4/b;;;;14-10+;13-10+;12-9+,18-14+;9-8+;;;;;;;;;;.
What are the key properties of ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline?
ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline has a molecular weight of 4012.80 g/mol, XLogP of 55.28, 64 rotatable bonds, 8 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-oxo-7-[[3-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylate;methane;2-[2-[[4-[(E)-2-quinolin-2-ylethenyl]phenoxy]methyl]phenoxy]propanoic acid;2-[2-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetic acid;2-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenoxy]propanoic acid;(E)-3-[2-[(E)-2-[4-(quinolin-2-ylmethoxy)phenyl]ethenyl]phenyl]prop-2-enoic acid;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzamide;3-[[7-(quinolin-2-ylmethoxy)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]benzoic acid;7-(quinolin-2-ylmethoxy)-2-[[3-(2H-tetrazol-5-yl)phenyl]methyl]-3,4-dihydro-2H-naphthalen-1-one;2-[[4-[(E)-2-[3-(2H-tetrazol-5-yl)phenyl]ethenyl]phenoxy]methyl]quinoline is sourced from PubChem (CID 157125365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).