[(S)-[(3R,4S)-4-methanoyl-1-methyl-2-oxidanylidene-pyrrolidin-3-yl]-phenyl-methyl] benzoate

Systemtic Name: [(S)-[(3R,4S)-4-methanoyl-1-methyl-2-oxidanylidene-pyrrolidin-3-yl]-phenyl-methyl] benzoate Openeye Name: [(S)-[(3R,4S)-4-formyl-1-methyl-2-oxo-pyrrolidin-3-yl]-phenyl-methyl] benzoate CAS Name: benzoic acid [(S)-[(3R,4S)-4-formyl-1-methyl-2-oxo-3-pyrrolidinyl]-phenylmethyl] ester IUPAC Name: [(S)-[(3R,4S)-4-formyl-1-methyl-2-oxopyrrolidin-3-yl]-phenylmethyl] benzoate Traditional Name: benzoic acid [(S)-[(3R,4S)-4-formyl-2-keto-1-methyl-pyrrolidin-3-yl]-phenyl-methyl] ester Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C(C1=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C=O

Isomeric SMILES

CN1C[C@H]([C@@H](C1=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C=O

InChI

InChI=1S/C20H19NO4/c1-21-12-16(13-22)17(19(21)23)18(14-8-4-2-5-9-14)25-20(24)15-10-6-3-7-11-15/h2-11,13,16-18H,12H2,1H3/t16-,17+,18+/m0/s1