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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2C)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=N5.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2C)C3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=N5.Cl

InChI

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