2-methoxyethyl (3S,4R)-4-(3-chlorophenyl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: 2-methoxyethyl (3S,4R)-4-(3-chlorophenyl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: 2-methoxyethyl (3S,4R)-4-(3-chlorophenyl)-2-methylene-6-oxo-piperidine-3-carboxylate CAS Name: (3S,4R)-4-(3-chlorophenyl)-2-methylene-6-oxo-3-piperidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (3S,4R)-4-(3-chlorophenyl)-2-methylidene-6-oxopiperidine-3-carboxylate Traditional Name: (3S,4R)-4-(3-chlorophenyl)-6-keto-2-methylene-nipecotic acid 2-methoxyethyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1C(CC(=O)NC1=C)C2=CC(=CC=C2)Cl

Isomeric SMILES

COCCOC(=O)[C@H]1[C@@H](CC(=O)NC1=C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H18ClNO4/c1-10-15(16(20)22-7-6-21-2)13(9-14(19)18-10)11-4-3-5-12(17)8-11/h3-5,8,13,15H,1,6-7,9H2,2H3,(H,18,19)/t13-,15+/m0/s1