N-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]-1-(phenylmethyl)piperidin-4-amine hydrochloride

Systemtic Name: N-[(3-chloranyl-4,5-dimethoxy-phenyl)methyl]-1-(phenylmethyl)piperidin-4-amine hydrochloride Openeye Name: 1-benzyl-N-[(3-chloro-4,5-dimethoxy-phenyl)methyl]piperidin-4-amine hydrochloride CAS Name: N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-(phenylmethyl)-4-piperidinamine hydrochloride IUPAC Name: 1-benzyl-N-[(3-chloro-4,5-dimethoxyphenyl)methyl]piperidin-4-amine hydrochloride Traditional Name: (1-benzyl-4-piperidyl)-(3-chloro-4,5-dimethoxy-benzyl)amine hydrochloride Formula: C21H28Cl2N2O2 MolecularWeight: 411.36522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2CCN(CC2)CC3=CC=CC=C3)Cl)OC.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2CCN(CC2)CC3=CC=CC=C3)Cl)OC.Cl

InChI

InChI=1S/C21H27ClN2O2.ClH/c1-25-20-13-17(12-19(22)21(20)26-2)14-23-18-8-10-24(11-9-18)15-16-6-4-3-5-7-16;/h3-7,12-13,18,23H,8-11,14-15H2,1-2H3;1H