[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-nitro-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 6-nitro-2-oxidanylidene-chromene-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 6-nitro-2-oxo-chromene-3-carboxylate CAS Name: 6-nitro-2-oxo-1-benzopyran-3-carboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 6-nitro-2-oxochromene-3-carboxylate Traditional Name: 2-keto-6-nitro-chromene-3-carboxylic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C20H15NO7 MolecularWeight: 381.3356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C20H15NO7/c1-11-3-5-13(6-4-11)18(22)12(2)27-19(23)16-10-14-9-15(21(25)26)7-8-17(14)28-20(16)24/h3-10,12H,1-2H3