[4-(4-cyanophenyl)phenyl] 4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-methyl-2-(2-quinolinyl)-1H-indol-3-yl]butanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butyric acid [4-(4-cyanophenyl)phenyl] ester Formula: C35H27N3O2 MolecularWeight: 521.60778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C35H27N3O2/c1-23-9-19-32-30(21-23)29(35(38-32)33-20-16-27-5-2-3-7-31(27)37-33)6-4-8-34(39)40-28-17-14-26(15-18-28)25-12-10-24(22-36)11-13-25/h2-3,5,7,9-21,38H,4,6,8H2,1H3