[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] (3S)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] (3S)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] (3S)-1-(o-tolyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] (3S)-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(o-tolyl)pyrrolidine-3-carboxylic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC(CC2=O)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O5/c1-14-7-5-6-10-17(14)24-12-16(11-19(24)26)21(28)29-13-18(25)22-23-20(27)15-8-3-2-4-9-15/h2-10,16H,11-13H2,1H3,(H,22,25)(H,23,27)/t16-/m0/s1