1-[4-[2-(4,4-dimethylcyclohexen-1-yl)phenyl]piperazin-1-yl]butan-2-one hydrochloride

Systemtic Name: 1-[4-[2-(4,4-dimethylcyclohexen-1-yl)phenyl]piperazin-1-yl]butan-2-one hydrochloride Openeye Name: 1-[4-[2-(4,4-dimethylcyclohexen-1-yl)phenyl]piperazin-1-yl]butan-2-one hydrochloride CAS Name: 1-[4-[2-(4,4-dimethyl-1-cyclohexenyl)phenyl]-1-piperazinyl]-2-butanone hydrochloride IUPAC Name: 1-[4-[2-(4,4-dimethylcyclohexen-1-yl)phenyl]piperazin-1-yl]butan-2-one hydrochloride Traditional Name: 1-[4-[2-(4,4-dimethylcyclohexen-1-yl)phenyl]piperazino]butan-2-one hydrochloride Formula: C22H33ClN2O MolecularWeight: 376.96322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CN1CCN(CC1)C2=CC=CC=C2C3=CCC(CC3)(C)C.Cl

Isomeric SMILES

CCC(=O)CN1CCN(CC1)C2=CC=CC=C2C3=CCC(CC3)(C)C.Cl

InChI

InChI=1S/C22H32N2O.ClH/c1-4-19(25)17-23-13-15-24(16-14-23)21-8-6-5-7-20(21)18-9-11-22(2,3)12-10-18;/h5-9H,4,10-17H2,1-3H3;1H