methyl (4S)-4-(4-chlorophenyl)-1-ethanoyl-piperidine-3-carboxylate

Systemtic Name: methyl (4S)-4-(4-chlorophenyl)-1-ethanoyl-piperidine-3-carboxylate Openeye Name: methyl (4S)-1-acetyl-4-(4-chlorophenyl)piperidine-3-carboxylate CAS Name: (4S)-1-acetyl-4-(4-chlorophenyl)-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-acetyl-4-(4-chlorophenyl)piperidine-3-carboxylate Traditional Name: (4S)-1-acetyl-4-(4-chlorophenyl)nipecotic acid methyl ester Formula: C15H18ClNO3 MolecularWeight: 295.76132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(C(C1)C(=O)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)N1CC[C@@H](C(C1)C(=O)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClNO3/c1-10(18)17-8-7-13(14(9-17)15(19)20-2)11-3-5-12(16)6-4-11/h3-6,13-14H,7-9H2,1-2H3/t13-,14?/m1/s1