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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5=CC=CO5)C.Cl

Isomeric SMILES

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5=CC=CO5)C.Cl

InChI

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