[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (3S)-1-benzamido-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (3S)-1-benzamido-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] (3S)-1-benzamido-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-benzamido-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] (3S)-1-benzamido-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-benzamido-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)[C@H]2CC(=O)N(C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-28-17-9-7-14(8-10-17)18(24)13-29-21(27)16-11-19(25)23(12-16)22-20(26)15-5-3-2-4-6-15/h2-10,16H,11-13H2,1H3,(H,22,26)/t16-/m0/s1