(2S,3R)-1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-6-oxo-piperidine-3-carboxylate CAS Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-6-oxo-3-piperidinecarboxylate IUPAC Name: (2S,3R)-1-butyl-2-(4-methoxyphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: (2S,3R)-1-butyl-6-keto-2-(4-methoxyphenyl)nipecotate Formula: C17H22NO4- MolecularWeight: 304.36088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)[O-])C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN1[C@@H]([C@@H](CCC1=O)C(=O)[O-])C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H23NO4/c1-3-4-11-18-15(19)10-9-14(17(20)21)16(18)12-5-7-13(22-2)8-6-12/h5-8,14,16H,3-4,9-11H2,1-2H3,(H,20,21)/p-1/t14-,16-/m1/s1