3-[5-nitro-3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-2-oxidanyl-4H-1,4-benzoxazine-6-carboxylic acid

Systemtic Name: 3-[5-nitro-3,4-bis(oxidanylidene)cyclohexa-1,5-dien-1-yl]-2-oxidanyl-4H-1,4-benzoxazine-6-carboxylic acid Openeye Name: 2-hydroxy-3-(5-nitro-3,4-dioxo-cyclohexa-1,5-dien-1-yl)-4H-1,4-benzoxazine-6-carboxylic acid CAS Name: 2-hydroxy-3-(5-nitro-3,4-dioxo-1-cyclohexa-1,5-dienyl)-4H-1,4-benzoxazine-6-carboxylic acid IUPAC Name: 2-hydroxy-3-(5-nitro-3,4-dioxocyclohexa-1,5-dien-1-yl)-4H-1,4-benzoxazine-6-carboxylic acid Traditional Name: 3-(3,4-diketo-5-nitro-cyclohexa-1,5-dien-1-yl)-2-hydroxy-4H-1,4-benzoxazine-6-carboxylic acid Formula: C15H8N2O8 MolecularWeight: 344.23262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)NC(=C(O2)O)C3=CC(=O)C(=O)C(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)NC(=C(O2)O)C3=CC(=O)C(=O)C(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H8N2O8/c18-10-5-7(4-9(13(10)19)17(23)24)12-15(22)25-11-2-1-6(14(20)21)3-8(11)16-12/h1-5,16,22H,(H,20,21)