1-[2-(4,4-dimethylcyclohexyl)-4-piperidin-1-yl-phenyl]-4-(furan-3-ylmethyl)piperazine hydrochloride

Systemtic Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidin-1-yl-phenyl]-4-(furan-3-ylmethyl)piperazine hydrochloride Openeye Name: 1-[2-(4,4-dimethylcyclohexyl)-4-(1-piperidyl)phenyl]-4-(3-furylmethyl)piperazine hydrochloride CAS Name: 1-[2-(4,4-dimethylcyclohexyl)-4-(1-piperidinyl)phenyl]-4-(3-furanylmethyl)piperazine hydrochloride IUPAC Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidin-1-ylphenyl]-4-(furan-3-ylmethyl)piperazine hydrochloride Traditional Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidino-phenyl]-4-(3-furfuryl)piperazine hydrochloride Formula: C28H42ClN3O MolecularWeight: 472.10558

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5=COC=C5)C.Cl

Isomeric SMILES

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5=COC=C5)C.Cl

InChI

InChI=1S/C28H41N3O.ClH/c1-28(2)11-8-24(9-12-28)26-20-25(30-13-4-3-5-14-30)6-7-27(26)31-17-15-29(16-18-31)21-23-10-19-32-22-23;/h6-7,10,19-20,22,24H,3-5,8-9,11-18,21H2,1-2H3;1H