2-[ethanoyl-[(2S)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]benzoate

Systemtic Name: 2-[ethanoyl-[(2S)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]benzoate Openeye Name: 2-[acetyl-[(1S)-1-methyl-2-oxido-2-oxo-ethyl]amino]benzoate CAS Name: 2-[acetyl-[(2S)-1-oxido-1-oxopropan-2-yl]amino]benzoate IUPAC Name: 2-[acetyl-[(2S)-1-oxido-1-oxopropan-2-yl]amino]benzoate Traditional Name: 2-[acetyl-[(1S)-2-keto-1-methyl-2-oxido-ethyl]amino]benzoate Formula: C12H11NO5-2 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(C1=CC=CC=C1C(=O)[O-])C(=O)C

Isomeric SMILES

C[C@@H](C(=O)[O-])N(C1=CC=CC=C1C(=O)[O-])C(=O)C

InChI

InChI=1S/C12H13NO5/c1-7(11(15)16)13(8(2)14)10-6-4-3-5-9(10)12(17)18/h3-7H,1-2H3,(H,15,16)(H,17,18)/p-2/t7-/m0/s1