(2-azanyl-2-oxidanylidene-ethyl) (2S,3S)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (2S,3S)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) (2S,3S)-2-(4-methoxyphenyl)-6-oxo-1-(p-tolyl)piperidine-3-carboxylate CAS Name: (2S,3S)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-6-oxo-3-piperidinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (2S,3S)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: (2S,3S)-6-keto-2-(4-methoxyphenyl)-1-(p-tolyl)nipecotic acid (2-amino-2-keto-ethyl) ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OCC(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H]([C@H](CCC2=O)C(=O)OCC(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O5/c1-14-3-7-16(8-4-14)24-20(26)12-11-18(22(27)29-13-19(23)25)21(24)15-5-9-17(28-2)10-6-15/h3-10,18,21H,11-13H2,1-2H3,(H2,23,25)/t18-,21+/m0/s1