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

Systemtic Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenoxy-cyclohexan-1-ol hydrochloride Openeye Name: 2-(dimethylaminomethyl)-1-[3-(2-methylallyloxy)phenyl]-4-phenoxy-cyclohexanol hydrochloride CAS Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenoxy-1-cyclohexanol hydrochloride IUPAC Name: 2-(dimethylaminomethyl)-1-[3-(2-methylprop-2-enoxy)phenyl]-4-phenoxycyclohexan-1-ol hydrochloride Traditional Name: 2-(dimethylaminomethyl)-1-[3-(2-methylallyloxy)phenyl]-4-phenoxy-cyclohexanol hydrochloride Formula: C25H34ClNO3 MolecularWeight: 431.99536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=CC=CC(=C1)C2(CCC(CC2CN(C)C)OC3=CC=CC=C3)O.Cl

Isomeric SMILES

CC(=C)COC1=CC=CC(=C1)C2(CCC(CC2CN(C)C)OC3=CC=CC=C3)O.Cl

InChI

InChI=1S/C25H33NO3.ClH/c1-19(2)18-28-23-12-8-9-20(15-23)25(27)14-13-24(16-21(25)17-26(3)4)29-22-10-6-5-7-11-22;/h5-12,15,21,24,27H,1,13-14,16-18H2,2-4H3;1H