4-[(3S)-2,5-bis(oxidanylidene)-3-[(1S)-1-phenylethyl]pyrrolidin-1-yl]benzoate

Systemtic Name: 4-[(3S)-2,5-bis(oxidanylidene)-3-[(1S)-1-phenylethyl]pyrrolidin-1-yl]benzoate Openeye Name: 4-[(3S)-2,5-dioxo-3-[(1S)-1-phenylethyl]pyrrolidin-1-yl]benzoate CAS Name: 4-[(3S)-2,5-dioxo-3-[(1S)-1-phenylethyl]-1-pyrrolidinyl]benzoate IUPAC Name: 4-[(3S)-2,5-dioxo-3-[(1S)-1-phenylethyl]pyrrolidin-1-yl]benzoate Traditional Name: 4-[(3S)-2,5-diketo-3-[(1S)-1-phenylethyl]pyrrolidino]benzoate Formula: C19H16NO4- MolecularWeight: 322.33464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC(=O)N(C1=O)C2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H]1CC(=O)N(C1=O)C2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H17NO4/c1-12(13-5-3-2-4-6-13)16-11-17(21)20(18(16)22)15-9-7-14(8-10-15)19(23)24/h2-10,12,16H,11H2,1H3,(H,23,24)/p-1/t12-,16+/m1/s1