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

Systemtic Name: 4-[(2R)-2-methyl-4-[(2R)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(2R)-2-methyl-4-[(1R)-1-methyl-2-oxido-2-oxo-ethyl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoate CAS Name: 4-[(2R)-2-methyl-4-[(2R)-1-oxido-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[(2R)-2-methyl-4-[(2R)-1-oxido-1-oxopropan-2-yl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(2R)-3-keto-4-[(1R)-2-keto-1-methyl-2-oxido-ethyl]-2-methyl-1,4-benzoxazin-6-yl]butyrate Formula: C16H15NO7-2 MolecularWeight: 333.2928

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])C(C)C(=O)[O-]

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])[C@H](C)C(=O)[O-]

InChI

InChI=1S/C16H17NO7/c1-8(16(22)23)17-11-7-10(12(18)4-6-14(19)20)3-5-13(11)24-9(2)15(17)21/h3,5,7-9H,4,6H2,1-2H3,(H,19,20)(H,22,23)/p-2/t8-,9-/m1/s1