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

Systemtic Name: (2S)-2-[(2S)-6-methyl-2-(2-oxidanidyl-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]butanoate Openeye Name: (2S)-2-[(2S)-6-methyl-2-(2-oxido-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-4-yl]butanoate CAS Name: (2S)-2-[(2S)-6-methyl-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]butanoate IUPAC Name: (2S)-2-[(2S)-6-methyl-2-(2-oxido-2-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]butanoate Traditional Name: (2S)-2-[(2S)-3-keto-2-(2-keto-2-oxido-ethyl)-6-methyl-1,4-benzoxazin-4-yl]butyrate Formula: C15H15NO6-2 MolecularWeight: 305.2827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO6/c1-3-9(15(20)21)16-10-6-8(2)4-5-11(10)22-12(14(16)19)7-13(17)18/h4-6,9,12H,3,7H2,1-2H3,(H,17,18)(H,20,21)/p-2/t9-,12-/m0/s1