(2S)-2-[(2S)-6-chloranyl-2-(2-oxidanidyl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: (2S)-2-[(2S)-6-chloranyl-2-(2-oxidanidyl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: (2S)-2-[(2S)-6-chloro-2-(2-oxido-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2S)-6-chloro-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate IUPAC Name: (2S)-2-[(2S)-6-chloro-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2S)-6-chloro-3-keto-2-(2-keto-2-oxido-ethyl)-1,4-benzoxazin-4-yl]propionate Formula: C13H10ClNO6-2 MolecularWeight: 311.6746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N1C2=C(C=CC(=C2)Cl)OC(C1=O)CC(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])N1C2=C(C=CC(=C2)Cl)O[C@H](C1=O)CC(=O)[O-]

InChI

InChI=1S/C13H12ClNO6/c1-6(13(19)20)15-8-4-7(14)2-3-9(8)21-10(12(15)18)5-11(16)17/h2-4,6,10H,5H2,1H3,(H,16,17)(H,19,20)/p-2/t6-,10-/m0/s1