[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino] 3,5-dinitrobenzoate

Systemtic Name: [(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino] 3,5-dinitrobenzoate Openeye Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(4-ketocyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C13H7N3O7 MolecularWeight: 317.21058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H7N3O7/c17-12-3-1-9(2-4-12)14-23-13(18)8-5-10(15(19)20)7-11(6-8)16(21)22/h1-7H