(1,6-dimethyl-2-phenyl-indol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone hydrochloride

Systemtic Name: (1,6-dimethyl-2-phenyl-indol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone hydrochloride Openeye Name: (1,6-dimethyl-2-phenyl-indol-3-yl)-[4-(3-pyridyl)piperazin-1-yl]methanone hydrochloride CAS Name: (1,6-dimethyl-2-phenyl-3-indolyl)-[4-(3-pyridinyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (1,6-dimethyl-2-phenylindol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone hydrochloride Traditional Name: (1,6-dimethyl-2-phenyl-indol-3-yl)-[4-(3-pyridyl)piperazino]methanone hydrochloride Formula: C26H27ClN4O MolecularWeight: 446.97178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2C)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CN=CC=C5.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2C)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CN=CC=C5.Cl

InChI

InChI=1S/C26H26N4O.ClH/c1-19-10-11-22-23(17-19)28(2)25(20-7-4-3-5-8-20)24(22)26(31)30-15-13-29(14-16-30)21-9-6-12-27-18-21;/h3-12,17-18H,13-16H2,1-2H3;1H