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

Systemtic Name: [(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate Openeye Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [(4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [(4-ketocyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C12H8N2O6S MolecularWeight: 308.26672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)ON=C2C=CC(=O)C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)ON=C2C=CC(=O)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O6S/c15-11-6-4-9(5-7-11)13-20-21(18,19)12-3-1-2-10(8-12)14(16)17/h1-8H