3-(4-azanylbutyl)-2-(1-methylbenzimidazol-2-yl)-1H-indole-5-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-(1-methylbenzimidazol-2-yl)-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(1-methylbenzimidazol-2-yl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(1-methyl-2-benzimidazolyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(1-methylbenzimidazol-2-yl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(1-methylbenzimidazol-2-yl)-1H-indole-5-carboxylic acid Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

InChI

InChI=1S/C21H22N4O2/c1-25-18-8-3-2-7-17(18)24-20(25)19-14(6-4-5-11-22)15-12-13(21(26)27)9-10-16(15)23-19/h2-3,7-10,12,23H,4-6,11,22H2,1H3,(H,26,27)