2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenylmethoxy-cyclohexan-1-ol hydrochloride

Systemtic Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenylmethoxy-cyclohexan-1-ol hydrochloride Openeye Name: 4-benzyloxy-2-(dimethylaminomethyl)-1-[3-(2-methylallyloxy)phenyl]cyclohexanol hydrochloride CAS Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenylmethoxy-1-cyclohexanol hydrochloride IUPAC Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenylmethoxycyclohexan-1-ol hydrochloride Traditional Name: 4-benzoxy-2-(dimethylaminomethyl)-1-[3-(2-methylallyloxy)phenyl]cyclohexanol hydrochloride Formula: C26H36ClNO3 MolecularWeight: 446.02194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=CC=CC(=C1)C2(CCC(CC2CN(C)C)OCC3=CC=CC=C3)O.Cl

Isomeric SMILES

CC(=C)COC1=CC=CC(=C1)C2(CCC(CC2CN(C)C)OCC3=CC=CC=C3)O.Cl

InChI

InChI=1S/C26H35NO3.ClH/c1-20(2)18-29-24-12-8-11-22(15-24)26(28)14-13-25(16-23(26)17-27(3)4)30-19-21-9-6-5-7-10-21;/h5-12,15,23,25,28H,1,13-14,16-19H2,2-4H3;1H