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

Systemtic Name: 3-(4-azanylbutyl)-7-methyl-2-phenyl-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-methyl-2-phenyl-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-methyl-2-phenyl-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-methyl-2-phenyl-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-methyl-2-phenyl-1H-indole-4-carboxylic acid Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O2/c1-13-10-11-16(20(23)24)17-15(9-5-6-12-21)19(22-18(13)17)14-7-3-2-4-8-14/h2-4,7-8,10-11,22H,5-6,9,12,21H2,1H3,(H,23,24)