(2S)-2-methyl-7-nitro-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: (2S)-2-methyl-7-nitro-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylic acid Openeye Name: (2S)-2-methyl-7-nitro-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid CAS Name: (2S)-2-methyl-7-nitro-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid IUPAC Name: (2S)-2-methyl-7-nitro-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid Traditional Name: (2S)-3-keto-2-methyl-7-nitro-4H-1,4-benzoxazine-2-carboxylic acid Formula: C10H8N2O6 MolecularWeight: 252.18032

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=C(O1)C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C[C@]1(C(=O)NC2=C(O1)C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C10H8N2O6/c1-10(9(14)15)8(13)11-6-3-2-5(12(16)17)4-7(6)18-10/h2-4H,1H3,(H,11,13)(H,14,15)/t10-/m0/s1