4-[(2S)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylate

Systemtic Name: 4-[(2S)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-1,4-benzoxazine-7-carboxylate Openeye Name: 4-[(1S)-1-methyl-2-oxido-2-oxo-ethyl]-3-oxo-1,4-benzoxazine-7-carboxylate CAS Name: 4-[(2S)-1-oxido-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazine-7-carboxylate IUPAC Name: 4-[(2S)-1-oxido-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazine-7-carboxylate Traditional Name: 3-keto-4-[(1S)-2-keto-1-methyl-2-oxido-ethyl]-1,4-benzoxazine-7-carboxylate Formula: C12H9NO6-2 MolecularWeight: 263.20296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])N1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C12H11NO6/c1-6(11(15)16)13-8-3-2-7(12(17)18)4-9(8)19-5-10(13)14/h2-4,6H,5H2,1H3,(H,15,16)(H,17,18)/p-2/t6-/m0/s1