2-(4-methoxyphenyl)carbonyl-6-(4-phenylpiperazin-1-yl)cyclohexan-1-one hydrochloride

Systemtic Name: 2-(4-methoxyphenyl)carbonyl-6-(4-phenylpiperazin-1-yl)cyclohexan-1-one hydrochloride Openeye Name: 2-(4-methoxybenzoyl)-6-(4-phenylpiperazin-1-yl)cyclohexanone hydrochloride CAS Name: 2-[(4-methoxyphenyl)-oxomethyl]-6-(4-phenyl-1-piperazinyl)-1-cyclohexanone hydrochloride IUPAC Name: 2-(4-methoxybenzoyl)-6-(4-phenylpiperazin-1-yl)cyclohexan-1-one hydrochloride Traditional Name: 2-p-anisoyl-6-(4-phenylpiperazino)cyclohexanone hydrochloride Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCCC(C2=O)N3CCN(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CCCC(C2=O)N3CCN(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H28N2O3.ClH/c1-29-20-12-10-18(11-13-20)23(27)21-8-5-9-22(24(21)28)26-16-14-25(15-17-26)19-6-3-2-4-7-19;/h2-4,6-7,10-13,21-22H,5,8-9,14-17H2,1H3;1H