3-(4-azanylbutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-methyl-2-(2-phenylphenyl)-1H-indole-4-carboxylic acid Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(=O)O)C(=C(N2)C3=CC=CC=C3C4=CC=CC=C4)CCCCN

Isomeric SMILES

CC1=C2C(=C(C=C1)C(=O)O)C(=C(N2)C3=CC=CC=C3C4=CC=CC=C4)CCCCN

InChI

InChI=1S/C26H26N2O2/c1-17-14-15-22(26(29)30)23-21(13-7-8-16-27)25(28-24(17)23)20-12-6-5-11-19(20)18-9-3-2-4-10-18/h2-6,9-12,14-15,28H,7-8,13,16,27H2,1H3,(H,29,30)