methyl (3S,4S)-4-(4-chlorophenyl)-1-methyl-piperidine-3-carboxylate hydrochloride

Systemtic Name: methyl (3S,4S)-4-(4-chlorophenyl)-1-methyl-piperidine-3-carboxylate hydrochloride Openeye Name: methyl (3S,4S)-4-(4-chlorophenyl)-1-methyl-piperidine-3-carboxylate hydrochloride CAS Name: (3S,4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl (3S,4S)-4-(4-chlorophenyl)-1-methylpiperidine-3-carboxylate hydrochloride Traditional Name: (3S,4S)-4-(4-chlorophenyl)-1-methyl-nipecotic acid methyl ester hydrochloride Formula: C14H19Cl2NO2 MolecularWeight: 304.21216

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)C(=O)OC)C2=CC=C(C=C2)Cl.Cl

Isomeric SMILES

CN1CC[C@@H]([C@@H](C1)C(=O)OC)C2=CC=C(C=C2)Cl.Cl

InChI

InChI=1S/C14H18ClNO2.ClH/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10;/h3-6,12-13H,7-9H2,1-2H3;1H/t12-,13-;/m1./s1