1-[3-(4-methylpiperazin-1-yl)propyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid

Systemtic Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid Openeye Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(5-phenyl-3-pyridyl)indole-4-carboxylic acid CAS Name: 1-[3-(4-methyl-1-piperazinyl)propyl]-3-(5-phenyl-3-pyridinyl)-4-indolecarboxylic acid IUPAC Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid Traditional Name: 1-[3-(4-methylpiperazino)propyl]-3-(5-phenyl-3-pyridyl)indole-4-carboxylic acid Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN2C=C(C3=C(C=CC=C32)C(=O)O)C4=CN=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CCCN2C=C(C3=C(C=CC=C32)C(=O)O)C4=CN=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2/c1-30-13-15-31(16-14-30)11-6-12-32-20-25(27-24(28(33)34)9-5-10-26(27)32)23-17-22(18-29-19-23)21-7-3-2-4-8-21/h2-5,7-10,17-20H,6,11-16H2,1H3,(H,33,34)