[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate

C204H150F18O40 — CID 157164437

IUPAC[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate
SMILESC=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3C)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)cc3C)o2)cc1
InChIInChI=1S/3C26H19F3O5.C26H22O5.3C25H17F3O5.C25H20O5/c1-4-24(30)34-23-13-6-17(15-21(23)26(27,28)29)5-9-19-12-14-22(32-19)18-7-10-20(11-8-18)33-25(31)16(2)3;1-4-24(30)33-20-10-7-18(8-11-20)23-14-13-19(32-23)9-5-17-6-12-21(34-25(31)16(2)3)15-22(17)26(27,28)29;1-4-24(30)34-23-13-8-18(15-21(23)26(27,28)29)22-14-12-19(32-22)9-5-17-6-10-20(11-7-17)33-25(31)16(2)3;1-5-25(27)30-21-10-7-19(8-11-21)6-9-20-13-15-24(29-20)23-14-12-22(16-18(23)4)31-26(28)17(2)3;1-3-23(29)32-19-10-7-17(8-11-19)21-14-12-18(31-21)9-5-16-6-13-22(33-24(30)4-2)20(15-16)25(26,27)28;1-3-23(29)32-19-10-7-17(8-11-19)22-14-13-18(31-22)9-5-16-6-12-20(33-24(30)4-2)15-21(16)25(26,27)28;1-3-23(29)32-19-10-6-16(7-11-19)5-9-18-12-14-21(31-18)17-8-13-22(33-24(30)4-2)20(15-17)25(26,27)28;1-4-24(26)29-20-10-7-18(8-11-20)6-9-19-13-15-23(28-19)22-14-12-21(16-17(22)3)30-25(27)5-2/h3*4-15H,1-2H2,3H3;5-16H,1-2H2,3-4H3;3*3-15H,1-2H2;4-16H,1-2H2,3H3/b3*9-5+;9-6+;3*9-5+;9-6+
InChIKeyAMSZAWJDXRQMAF-UIVBAPDGSA-N
MW3583.37 g/mol
LogP50.69
Rot. Bonds56

About [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate

[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate (PubChem CID 157164437) has the molecular formula C204H150F18O40 and a molecular weight of 3583.37 g/mol. Its IUPAC name is [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate.

Molecular Properties

Compound Name[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate
PubChem CID157164437
Molecular FormulaC204H150F18O40
Molecular Weight3583.37 g/mol
Exact Mass3580.94
IUPAC Name[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate
SMILESC=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3C)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)cc3C)o2)cc1
InChIInChI=1S/3C26H19F3O5.C26H22O5.3C25H17F3O5.C25H20O5/c1-4-24(30)34-23-13-6-17(15-21(23)26(27,28)29)5-9-19-12-14-22(32-19)18-7-10-20(11-8-18)33-25(31)16(2)3;1-4-24(30)33-20-10-7-18(8-11-20)23-14-13-19(32-23)9-5-17-6-12-21(34-25(31)16(2)3)15-22(17)26(27,28)29;1-4-24(30)34-23-13-8-18(15-21(23)26(27,28)29)22-14-12-19(32-22)9-5-17-6-10-20(11-7-17)33-25(31)16(2)3;1-5-25(27)30-21-10-7-19(8-11-21)6-9-20-13-15-24(29-20)23-14-12-22(16-18(23)4)31-26(28)17(2)3;1-3-23(29)32-19-10-7-17(8-11-19)21-14-12-18(31-21)9-5-16-6-13-22(33-24(30)4-2)20(15-16)25(26,27)28;1-3-23(29)32-19-10-7-17(8-11-19)22-14-13-18(31-22)9-5-16-6-12-20(33-24(30)4-2)15-21(16)25(26,27)28;1-3-23(29)32-19-10-6-16(7-11-19)5-9-18-12-14-21(31-18)17-8-13-22(33-24(30)4-2)20(15-17)25(26,27)28;1-4-24(26)29-20-10-7-18(8-11-20)6-9-19-13-15-23(28-19)22-14-12-21(16-17(22)3)30-25(27)5-2/h3*4-15H,1-2H2,3H3;5-16H,1-2H2,3-4H3;3*3-15H,1-2H2;4-16H,1-2H2,3H3/b3*9-5+;9-6+;3*9-5+;9-6+
InChIKeyAMSZAWJDXRQMAF-UIVBAPDGSA-N
XLogP50.69
TPSA525.92 Ų
H-Bond Donors
H-Bond Acceptors40
Rotatable Bonds56
Heavy Atoms262
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003583.37
LogP ≤ 550.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

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

Analyze [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate with MolForge

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Related Compounds

2-[2,3,4,5,6-Pentakis[5-[4-(trifluoromethyl)phenyl]furan-2-yl]phenyl]-5-[4-(trifluoromethyl)phenyl]furan
CID 71615619
[9-[8-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]oxybenzo[e][1]benzofuran-9-yl]benzo[e][1]benzofuran-8-yl] (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
CID 102469132
1,1,1-Trifluoropropan-2-yl 4-[4-(4-methoxyphenyl)benzoyl]oxy-2-methylbenzoate;1,1,1-trifluoropropan-2-yl 4-[4-(4-methoxyphenyl)benzoyl]oxy-3-methylbenzoate
CID 54175708
[4-[4-[4-[4-(6-Prop-2-enoyloxyhexoxy)benzoyl]oxy-2,3-bis(trifluoromethyl)phenyl]butyl]phenyl] 4-(2-prop-2-enoyloxyethoxy)benzoate
CID 58776347
[4-[4-[4-(4-Prop-2-enoyloxybutoxy)benzoyl]oxy-2,3-bis(trifluoromethyl)phenyl]-2,3-bis(trifluoromethyl)phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 58776365
[4-[3-Fluoro-4-[4-(4-prop-2-enoyloxybutoxy)benzoyl]oxy-2-(trifluoromethyl)phenyl]-2,3-bis(trifluoromethyl)phenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 59768968
[4-[4-[4-(4-Prop-2-enoyloxybutoxy)-2,3-bis(trifluoromethyl)phenyl]-2,3-bis(trifluoromethyl)phenoxy]carbonylphenyl] 4-(4-prop-2-enoyloxybutoxy)benzoate
CID 89021161
5-[1,1,1,3,3,3-hexafluoro-2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-4,7-dimethyl-3-phenyl-3H-1-benzofuran-2-one;7-methyl-5-[2-(7-methyl-2-oxo-3-phenyl-3H-1-benzofuran-5-yl)propan-2-yl]-3-phenyl-3H-1-benzofuran-2-one;5-[(2-oxo-3-phenyl-3H-1-benzofuran-5-yl)methyl]-3-phenyl-3H-1-benzofuran-2-one
CID 90847500
Methyl 2,3-dimethyl-4-[4-(trifluoromethoxy)benzoyl]oxybenzoate
CID 91090132
3-Ethoxy-4,6-difluoro-7-pentoxydibenzofuran;3-ethoxy-4,6-difluoro-7-(trifluoromethoxy)dibenzofuran;3-ethoxy-7-(4-ethylcyclohexyl)-4,6-difluorodibenzofuran;3-ethoxy-7-(4-ethyl-2-fluorophenyl)-4,6-difluorodibenzofuran;3-ethoxy-7-(4-ethylphenyl)-4,6-difluorodibenzofuran
CID 157217594
CID 157234963
CID 157234963
5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione;5-[4-[[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]-difluoromethyl]phenoxy]-2-benzofuran-1,3-dione;5-[4-[2-[4-[(1,3-dioxo-2-benzofuran-5-yl)oxy]phenyl]propan-2-yl]phenoxy]-2-benzofuran-1,3-dione;3-[(2Z,6E,12E,15E,17E)-15-[2-(2,5-dioxooxolan-3-yl)ethylidene]-9-ethenyl-3-propylicosa-2,6,12,17-tetraenyl]oxolane-2,5-dione;3-[(2E,4E)-6-(2,5-dioxooxolan-3-yl)hexa-2,4-dienyl]furan-2,5-dione;6-(2,5-dioxooxolan-3-yl)-7-methyl-3a,4,5,7a-tetrahydro-2-benzofuran-1,3-dione;furo[3,4-f][2]benzofuran-1,3,5,7-tetrone
CID 157242967

Frequently Asked Questions

What is the IUPAC name of [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate?
The IUPAC name of [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate (CID 157164437) is [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate.
What is the SMILES notation for [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate?
The canonical SMILES for [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate is C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C(=C)C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(-c2ccc(/C=C/c3ccc(OC(=O)C=C)cc3C(F)(F)F)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)o2)cc1C(F)(F)F.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C(=C)C)cc3C)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)c(C(F)(F)F)c3)o2)cc1.C=CC(=O)Oc1ccc(/C=C/c2ccc(-c3ccc(OC(=O)C=C)cc3C)o2)cc1.
What is the InChIKey of [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate?
The InChIKey is AMSZAWJDXRQMAF-UIVBAPDGSA-N. The full InChI is InChI=1S/3C26H19F3O5.C26H22O5.3C25H17F3O5.C25H20O5/c1-4-24(30)34-23-13-6-17(15-21(23)26(27,28)29)5-9-19-12-14-22(32-19)18-7-10-20(11-8-18)33-25(31)16(2)3;1-4-24(30)33-20-10-7-18(8-11-20)23-14-13-19(32-23)9-5-17-6-12-21(34-25(31)16(2)3)15-22(17)26(27,28)29;1-4-24(30)34-23-13-8-18(15-21(23)26(27,28)29)22-14-12-19(32-22)9-5-17-6-10-20(11-7-17)33-25(31)16(2)3;1-5-25(27)30-21-10-7-19(8-11-21)6-9-20-13-15-24(29-20)23-14-12-22(16-18(23)4)31-26(28)17(2)3;1-3-23(29)32-19-10-7-17(8-11-19)21-14-12-18(31-21)9-5-16-6-13-22(33-24(30)4-2)20(15-16)25(26,27)28;1-3-23(29)32-19-10-7-17(8-11-19)22-14-13-18(31-22)9-5-16-6-12-20(33-24(30)4-2)15-21(16)25(26,27)28;1-3-23(29)32-19-10-6-16(7-11-19)5-9-18-12-14-21(31-18)17-8-13-22(33-24(30)4-2)20(15-17)25(26,27)28;1-4-24(26)29-20-10-7-18(8-11-20)6-9-19-13-15-23(28-19)22-14-12-21(16-17(22)3)30-25(27)5-2/h3*4-15H,1-2H2,3H3;5-16H,1-2H2,3-4H3;3*3-15H,1-2H2;4-16H,1-2H2,3H3/b3*9-5+;9-6+;3*9-5+;9-6+.
What are the key properties of [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate?
[3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate has a molecular weight of 3583.37 g/mol, XLogP of 50.69, 56 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-4-[5-[(E)-2-(4-prop-2-enoyloxyphenyl)ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-(2-methyl-4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]phenyl] prop-2-enoate;[4-[(E)-2-[5-(4-prop-2-enoyloxyphenyl)furan-2-yl]ethenyl]-3-(trifluoromethyl)phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] 2-methylprop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-2-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[5-[(E)-2-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]ethenyl]furan-2-yl]phenyl] prop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate;[4-[(E)-2-[5-[4-prop-2-enoyloxy-3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]phenyl] prop-2-enoate is sourced from PubChem (CID 157164437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).