2-butyl-3-[[1-(2-cyanophenyl)indol-4-yl]methyl]imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-3-[[1-(2-cyanophenyl)indol-4-yl]methyl]imidazole-4-carboxylic acid Openeye Name: 2-butyl-3-[[1-(2-cyanophenyl)indol-4-yl]methyl]imidazole-4-carboxylic acid CAS Name: 2-butyl-3-[[1-(2-cyanophenyl)-4-indolyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-3-[[1-(2-cyanophenyl)indol-4-yl]methyl]imidazole-4-carboxylic acid Traditional Name: 2-butyl-3-[[1-(2-cyanophenyl)indol-4-yl]methyl]imidazole-4-carboxylic acid Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=C3C=CN(C3=CC=C2)C4=CC=CC=C4C#N)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=C3C=CN(C3=CC=C2)C4=CC=CC=C4C#N)C(=O)O

InChI

InChI=1S/C24H22N4O2/c1-2-3-11-23-26-15-22(24(29)30)28(23)16-18-8-6-10-21-19(18)12-13-27(21)20-9-5-4-7-17(20)14-25/h4-10,12-13,15H,2-3,11,16H2,1H3,(H,29,30)