(2S)-2-[(2S)-2-(2-oxidanidyl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: (2S)-2-[(2S)-2-(2-oxidanidyl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2S)-2-[(2S)-2-(2-oxido-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2S)-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2S)-2-[(2S)-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2S)-3-keto-2-(2-keto-2-oxido-ethyl)-1,4-benzoxazin-4-yl]propionate Formula: C13H11NO6-2 MolecularWeight: 277.22954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C2=CC=CC=C2OC(C1=O)CC(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])N1C2=CC=CC=C2O[C@H](C1=O)CC(=O)[O-]

InChI

InChI=1S/C13H13NO6/c1-7(13(18)19)14-8-4-2-3-5-9(8)20-10(12(14)17)6-11(15)16/h2-5,7,10H,6H2,1H3,(H,15,16)(H,18,19)/p-2/t7-,10-/m0/s1