6-acetyloxy-2-methyl-5-nitro-4-oxidanylidene-chromene-7-carboxylic acid

Systemtic Name: 6-acetyloxy-2-methyl-5-nitro-4-oxidanylidene-chromene-7-carboxylic acid Openeye Name: 6-acetoxy-2-methyl-5-nitro-4-oxo-chromene-7-carboxylic acid CAS Name: 6-acetyloxy-2-methyl-5-nitro-4-oxo-1-benzopyran-7-carboxylic acid IUPAC Name: 6-acetyloxy-2-methyl-5-nitro-4-oxochromene-7-carboxylic acid Traditional Name: 6-acetoxy-4-keto-2-methyl-5-nitro-chromene-7-carboxylic acid Formula: C13H9NO8 MolecularWeight: 307.21246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9NO8/c1-5-3-8(16)10-9(21-5)4-7(13(17)18)12(22-6(2)15)11(10)14(19)20/h3-4H,1-2H3,(H,17,18)