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

Systemtic Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidin-1-yl-phenyl]-4-(oxan-4-ylmethyl)piperazine hydrochloride Openeye Name: 1-[2-(4,4-dimethylcyclohexyl)-4-(1-piperidyl)phenyl]-4-(tetrahydropyran-4-ylmethyl)piperazine hydrochloride CAS Name: 1-[2-(4,4-dimethylcyclohexyl)-4-(1-piperidinyl)phenyl]-4-(4-oxanylmethyl)piperazine hydrochloride IUPAC Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidin-1-ylphenyl]-4-(oxan-4-ylmethyl)piperazine hydrochloride Traditional Name: 1-[2-(4,4-dimethylcyclohexyl)-4-piperidino-phenyl]-4-(tetrahydropyran-4-ylmethyl)piperazine hydrochloride Formula: C29H48ClN3O MolecularWeight: 490.16392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5CCOCC5)C.Cl

Isomeric SMILES

CC1(CCC(CC1)C2=C(C=CC(=C2)N3CCCCC3)N4CCN(CC4)CC5CCOCC5)C.Cl

InChI

InChI=1S/C29H47N3O.ClH/c1-29(2)12-8-25(9-13-29)27-22-26(31-14-4-3-5-15-31)6-7-28(27)32-18-16-30(17-19-32)23-24-10-20-33-21-11-24;/h6-7,22,24-25H,3-5,8-21,23H2,1-2H3;1H