3-[2-(dimethylaminomethyl)-1-oxidanyl-4-phenylmethoxy-cyclohexyl]phenol hydrochloride

Systemtic Name: 3-[2-(dimethylaminomethyl)-1-oxidanyl-4-phenylmethoxy-cyclohexyl]phenol hydrochloride Openeye Name: 3-[4-benzyloxy-2-(dimethylaminomethyl)-1-hydroxy-cyclohexyl]phenol hydrochloride CAS Name: 3-[2-(dimethylaminomethyl)-1-hydroxy-4-phenylmethoxycyclohexyl]phenol hydrochloride IUPAC Name: 3-[2-(dimethylaminomethyl)-1-hydroxy-4-phenylmethoxycyclohexyl]phenol hydrochloride Traditional Name: 3-[4-benzoxy-2-(dimethylaminomethyl)-1-hydroxy-cyclohexyl]phenol hydrochloride Formula: C22H30ClNO3 MolecularWeight: 391.9315

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)O)O)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)CC1CC(CCC1(C2=CC(=CC=C2)O)O)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H29NO3.ClH/c1-23(2)15-19-14-21(26-16-17-7-4-3-5-8-17)11-12-22(19,25)18-9-6-10-20(24)13-18;/h3-10,13,19,21,24-25H,11-12,14-16H2,1-2H3;1H