[(E)-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 2,4-dinitrobenzoate

Systemtic Name: [(E)-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 2,4-dinitrobenzoate Openeye Name: [(E)-(2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [(E)-(2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid [(E)-(4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C14H9N3O7 MolecularWeight: 331.23716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=CC(=O)C=C/C1=N\OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O7/c1-8-6-10(18)3-5-12(8)15-24-14(19)11-4-2-9(16(20)21)7-13(11)17(22)23/h2-7H,1H3/b15-12+