[(2R,3S)-2-cyano-1-[(4-methoxyphenyl)methyl]-5-oxidanylidene-pyrrolidin-3-yl] ethanoate

Systemtic Name: [(2R,3S)-2-cyano-1-[(4-methoxyphenyl)methyl]-5-oxidanylidene-pyrrolidin-3-yl] ethanoate Openeye Name: [(2R,3S)-2-cyano-1-[(4-methoxyphenyl)methyl]-5-oxo-pyrrolidin-3-yl] acetate CAS Name: acetic acid [(2R,3S)-2-cyano-1-[(4-methoxyphenyl)methyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: [(2R,3S)-2-cyano-1-[(4-methoxyphenyl)methyl]-5-oxopyrrolidin-3-yl] acetate Traditional Name: acetic acid [(2R,3S)-2-cyano-5-keto-1-p-anisyl-pyrrolidin-3-yl] ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=O)N(C1C#N)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)O[C@H]1CC(=O)N([C@@H]1C#N)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H16N2O4/c1-10(18)21-14-7-15(19)17(13(14)8-16)9-11-3-5-12(20-2)6-4-11/h3-6,13-14H,7,9H2,1-2H3/t13-,14+/m1/s1