(2,4-dinitrophenyl) 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]benzoate

Systemtic Name: (2,4-dinitrophenyl) 4-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]benzoate Openeye Name: (2,4-dinitrophenyl) 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]benzoate CAS Name: 4-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]benzoic acid (2,4-dinitrophenyl) ester IUPAC Name: (2,4-dinitrophenyl) 4-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]benzoate Traditional Name: 4-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid (2,4-dinitrophenyl) ester Formula: C20H13N3O7 MolecularWeight: 407.33312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=CNC2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=CNC2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H13N3O7/c24-17-8-1-13(2-9-17)12-21-15-5-3-14(4-6-15)20(25)30-19-10-7-16(22(26)27)11-18(19)23(28)29/h1-12,21H