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

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]butanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butyric acid [4-(4-cyanophenyl)phenyl] ester Formula: C31H25N3O2 MolecularWeight: 471.5491

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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=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)C5=CC=CC=N5

InChI

InChI=1S/C31H25N3O2/c1-21-8-17-28-27(19-21)26(31(34-28)29-6-2-3-18-33-29)5-4-7-30(35)36-25-15-13-24(14-16-25)23-11-9-22(20-32)10-12-23/h2-3,6,8-19,34H,4-5,7H2,1H3