1-[2-(4,4-diethylcyclohexen-1-yl)-5-methoxy-phenyl]-4-(oxan-4-ylmethyl)piperazine hydrochloride

Systemtic Name: 1-[2-(4,4-diethylcyclohexen-1-yl)-5-methoxy-phenyl]-4-(oxan-4-ylmethyl)piperazine hydrochloride Openeye Name: 1-[2-(4,4-diethylcyclohexen-1-yl)-5-methoxy-phenyl]-4-(tetrahydropyran-4-ylmethyl)piperazine hydrochloride CAS Name: 1-[2-(4,4-diethyl-1-cyclohexenyl)-5-methoxyphenyl]-4-(4-oxanylmethyl)piperazine hydrochloride IUPAC Name: 1-[2-(4,4-diethylcyclohexen-1-yl)-5-methoxyphenyl]-4-(oxan-4-ylmethyl)piperazine hydrochloride Traditional Name: 1-[2-(4,4-diethylcyclohexen-1-yl)-5-methoxy-phenyl]-4-(tetrahydropyran-4-ylmethyl)piperazine hydrochloride Formula: C27H43ClN2O2 MolecularWeight: 463.09552

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(=CC1)C2=C(C=C(C=C2)OC)N3CCN(CC3)CC4CCOCC4)CC.Cl

Isomeric SMILES

CCC1(CCC(=CC1)C2=C(C=C(C=C2)OC)N3CCN(CC3)CC4CCOCC4)CC.Cl

InChI

InChI=1S/C27H42N2O2.ClH/c1-4-27(5-2)12-8-23(9-13-27)25-7-6-24(30-3)20-26(25)29-16-14-28(15-17-29)21-22-10-18-31-19-11-22;/h6-8,20,22H,4-5,9-19,21H2,1-3H3;1H