dimethyl 1-[[4-(2-cyanophenyl)phenyl]methyl]-2-propyl-indole-3,7-dicarboxylate

Systemtic Name: dimethyl 1-[[4-(2-cyanophenyl)phenyl]methyl]-2-propyl-indole-3,7-dicarboxylate Openeye Name: dimethyl 1-[[4-(2-cyanophenyl)phenyl]methyl]-2-propyl-indole-3,7-dicarboxylate CAS Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-2-propylindole-3,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[[4-(2-cyanophenyl)phenyl]methyl]-2-propylindole-3,7-dicarboxylate Traditional Name: 1-[4-(2-cyanophenyl)benzyl]-2-propyl-indole-3,7-dicarboxylic acid dimethyl ester Formula: C29H26N2O4 MolecularWeight: 466.52774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=CC=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCC1=C(C2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=CC=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C29H26N2O4/c1-4-8-25-26(29(33)35-3)23-11-7-12-24(28(32)34-2)27(23)31(25)18-19-13-15-20(16-14-19)22-10-6-5-9-21(22)17-30/h5-7,9-16H,4,8,18H2,1-3H3