(2S,3R)-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (2S,3R)-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: (2S,3R)-1-(2-methoxyethyl)-6-oxo-2-(p-tolyl)piperidine-3-carboxylate CAS Name: (2S,3R)-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxo-3-piperidinecarboxylate IUPAC Name: (2S,3R)-1-(2-methoxyethyl)-2-(4-methylphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: (2S,3R)-6-keto-1-(2-methoxyethyl)-2-(p-tolyl)nipecotate Formula: C16H20NO4- MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(CCC(=O)N2CCOC)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2[C@@H](CCC(=O)N2CCOC)C(=O)[O-]

InChI

InChI=1S/C16H21NO4/c1-11-3-5-12(6-4-11)15-13(16(19)20)7-8-14(18)17(15)9-10-21-2/h3-6,13,15H,7-10H2,1-2H3,(H,19,20)/p-1/t13-,15-/m1/s1