hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate

C264H208N12O24 — CID 163839122

IUPAChexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate
SMILESCCCC[C@@]1(C[C@@]2(CCC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CCC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CC[C@@]1(C[C@@]2(CC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.O=C(CC[C@]1(C[C@]2(CCc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C(C[C@]1(C[C@]2(Cc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O
InChIInChI=1S/C50H38N2O2.C48H34N2O2.C42H38N2O2.2C40H34N2O2.C38H30N2O2.6CO2/c53-46(54-37-19-5-2-6-20-37)28-30-50(41-24-12-10-22-39(41)48-43(50)32-36-18-8-14-26-45(36)52-48)33-49(29-27-34-15-3-1-4-16-34)40-23-11-9-21-38(40)47-42(49)31-35-17-7-13-25-44(35)51-47;51-44(52-35-19-5-2-6-20-35)30-48(39-24-12-10-22-37(39)46-41(48)28-34-18-8-14-26-43(34)50-46)31-47(29-32-15-3-1-4-16-32)38-23-11-9-21-36(38)45-40(47)27-33-17-7-13-25-42(33)49-45;1-3-5-23-41(32-18-10-8-16-30(32)39-34(41)25-28-14-6-12-20-36(28)43-39)27-42(24-22-38(45)46-4-2)33-19-11-9-17-31(33)40-35(42)26-29-15-7-13-21-37(29)44-40;1-3-21-39(30-16-8-6-14-28(30)37-32(39)23-26-12-4-10-18-34(26)41-37)25-40(22-20-36(43)44-2)31-17-9-7-15-29(31)38-33(40)24-27-13-5-11-19-35(27)42-38;1-3-21-39(30-17-9-7-15-28(30)37-32(39)22-26-13-5-11-19-34(26)41-37)25-40(24-36(43)44-4-2)31-18-10-8-16-29(31)38-33(40)23-27-14-6-12-20-35(27)42-38;1-3-37(28-16-8-6-14-26(28)35-30(37)20-24-12-4-10-18-32(24)39-35)23-38(22-34(41)42-2)29-17-9-7-15-27(29)36-31(38)21-25-13-5-11-19-33(25)40-36;6*2-1-3/h1-26,31-32H,27-30,33H2;1-28H,29-31H2;6-21,25-26H,3-5,22-24,27H2,1-2H3;4-19,23-24H,3,20-22,25H2,1-2H3;5-20,22-23H,3-4,21,24-25H2,1-2H3;4-21H,3,22-23H2,1-2H3;;;;;;/t49-,50+;47-,48+;41-,42+;2*39-,40+;37-,38+;;;;;;/m111111....../s1
InChIKeyOKIQNYKEKNOPGH-BTAIUVBGSA-N
MW3932.63 g/mol
LogP55.21
Rot. Bonds44

About hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate

hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate (PubChem CID 163839122) has the molecular formula C264H208N12O24 and a molecular weight of 3932.63 g/mol. Its IUPAC name is hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate.

Molecular Properties

Compound Namehexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate
PubChem CID163839122
Molecular FormulaC264H208N12O24
Molecular Weight3932.63 g/mol
Exact Mass3929.54
IUPAC Namehexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate
SMILESCCCC[C@@]1(C[C@@]2(CCC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CCC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CC[C@@]1(C[C@@]2(CC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.O=C(CC[C@]1(C[C@]2(CCc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C(C[C@]1(C[C@]2(Cc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O
InChIInChI=1S/C50H38N2O2.C48H34N2O2.C42H38N2O2.2C40H34N2O2.C38H30N2O2.6CO2/c53-46(54-37-19-5-2-6-20-37)28-30-50(41-24-12-10-22-39(41)48-43(50)32-36-18-8-14-26-45(36)52-48)33-49(29-27-34-15-3-1-4-16-34)40-23-11-9-21-38(40)47-42(49)31-35-17-7-13-25-44(35)51-47;51-44(52-35-19-5-2-6-20-35)30-48(39-24-12-10-22-37(39)46-41(48)28-34-18-8-14-26-43(34)50-46)31-47(29-32-15-3-1-4-16-32)38-23-11-9-21-36(38)45-40(47)27-33-17-7-13-25-42(33)49-45;1-3-5-23-41(32-18-10-8-16-30(32)39-34(41)25-28-14-6-12-20-36(28)43-39)27-42(24-22-38(45)46-4-2)33-19-11-9-17-31(33)40-35(42)26-29-15-7-13-21-37(29)44-40;1-3-21-39(30-16-8-6-14-28(30)37-32(39)23-26-12-4-10-18-34(26)41-37)25-40(22-20-36(43)44-2)31-17-9-7-15-29(31)38-33(40)24-27-13-5-11-19-35(27)42-38;1-3-21-39(30-17-9-7-15-28(30)37-32(39)22-26-13-5-11-19-34(26)41-37)25-40(24-36(43)44-4-2)31-18-10-8-16-29(31)38-33(40)23-27-14-6-12-20-35(27)42-38;1-3-37(28-16-8-6-14-26(28)35-30(37)20-24-12-4-10-18-32(24)39-35)23-38(22-34(41)42-2)29-17-9-7-15-27(29)36-31(38)21-25-13-5-11-19-33(25)40-36;6*2-1-3/h1-26,31-32H,27-30,33H2;1-28H,29-31H2;6-21,25-26H,3-5,22-24,27H2,1-2H3;4-19,23-24H,3,20-22,25H2,1-2H3;5-20,22-23H,3-4,21,24-25H2,1-2H3;4-21H,3,22-23H2,1-2H3;;;;;;/t49-,50+;47-,48+;41-,42+;2*39-,40+;37-,38+;;;;;;/m111111....../s1
InChIKeyOKIQNYKEKNOPGH-BTAIUVBGSA-N
XLogP55.21
TPSA517.32 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds44
Heavy Atoms300
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003932.63
LogP ≤ 555.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Analyze hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate?
The IUPAC name of hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate (CID 163839122) is hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate.
What is the SMILES notation for hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate?
The canonical SMILES for hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate is CCCC[C@@]1(C[C@@]2(CCC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CC(=O)OCC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CCC[C@@]1(C[C@@]2(CCC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.CC[C@@]1(C[C@@]2(CC(=O)OC)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21.O=C(CC[C@]1(C[C@]2(CCc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C(C[C@]1(C[C@]2(Cc3ccccc3)c3ccccc3-c3nc4ccccc4cc32)c2ccccc2-c2nc3ccccc3cc21)Oc1ccccc1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.
What is the InChIKey of hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate?
The InChIKey is OKIQNYKEKNOPGH-BTAIUVBGSA-N. The full InChI is InChI=1S/C50H38N2O2.C48H34N2O2.C42H38N2O2.2C40H34N2O2.C38H30N2O2.6CO2/c53-46(54-37-19-5-2-6-20-37)28-30-50(41-24-12-10-22-39(41)48-43(50)32-36-18-8-14-26-45(36)52-48)33-49(29-27-34-15-3-1-4-16-34)40-23-11-9-21-38(40)47-42(49)31-35-17-7-13-25-44(35)51-47;51-44(52-35-19-5-2-6-20-35)30-48(39-24-12-10-22-37(39)46-41(48)28-34-18-8-14-26-43(34)50-46)31-47(29-32-15-3-1-4-16-32)38-23-11-9-21-36(38)45-40(47)27-33-17-7-13-25-42(33)49-45;1-3-5-23-41(32-18-10-8-16-30(32)39-34(41)25-28-14-6-12-20-36(28)43-39)27-42(24-22-38(45)46-4-2)33-19-11-9-17-31(33)40-35(42)26-29-15-7-13-21-37(29)44-40;1-3-21-39(30-16-8-6-14-28(30)37-32(39)23-26-12-4-10-18-34(26)41-37)25-40(22-20-36(43)44-2)31-17-9-7-15-29(31)38-33(40)24-27-13-5-11-19-35(27)42-38;1-3-21-39(30-17-9-7-15-28(30)37-32(39)22-26-13-5-11-19-34(26)41-37)25-40(24-36(43)44-4-2)31-18-10-8-16-29(31)38-33(40)23-27-14-6-12-20-35(27)42-38;1-3-37(28-16-8-6-14-26(28)35-30(37)20-24-12-4-10-18-32(24)39-35)23-38(22-34(41)42-2)29-17-9-7-15-27(29)36-31(38)21-25-13-5-11-19-33(25)40-36;6*2-1-3/h1-26,31-32H,27-30,33H2;1-28H,29-31H2;6-21,25-26H,3-5,22-24,27H2,1-2H3;4-19,23-24H,3,20-22,25H2,1-2H3;5-20,22-23H,3-4,21,24-25H2,1-2H3;4-21H,3,22-23H2,1-2H3;;;;;;/t49-,50+;47-,48+;41-,42+;2*39-,40+;37-,38+;;;;;;/m111111....../s1.
What are the key properties of hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate?
hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate has a molecular weight of 3932.63 g/mol, XLogP of 55.21, 44 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for hexakis(carbon dioxide);ethyl 3-[(11S)-11-[[(11R)-11-butylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;ethyl 2-[(11R)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 2-[(11R)-11-[[(11R)-11-ethylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;methyl 3-[(11S)-11-[[(11R)-11-propylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate;phenyl 2-[(11R)-11-[[(11R)-11-benzylindeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]acetate;phenyl 3-[(11S)-11-[[(11R)-11-(2-phenylethyl)indeno[1,2-b]quinolin-11-yl]methyl]indeno[1,2-b]quinolin-11-yl]propanoate is sourced from PubChem (CID 163839122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).