(3S)-1-[(2-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-[(2-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-[(2-methylbenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[[(2-methylphenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-[(2-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(o-toluoylamino)pyrrolidine-3-carboxylate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NN2CC(CC2=O)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)NN2C[C@H](CC2=O)C(=O)[O-]

InChI

InChI=1S/C13H14N2O4/c1-8-4-2-3-5-10(8)12(17)14-15-7-9(13(18)19)6-11(15)16/h2-5,9H,6-7H2,1H3,(H,14,17)(H,18,19)/p-1/t9-/m0/s1