3-nitro-4-[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide

Systemtic Name: 3-nitro-4-[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Openeye Name: 3-nitro-4-[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]benzenesulfonamide CAS Name: 3-nitro-4-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]benzenesulfonamide IUPAC Name: 3-nitro-4-[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Traditional Name: 4-[N'-[(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-3-nitro-benzenesulfonamide Formula: C13H12N4O5S MolecularWeight: 336.32318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C(=O)C=C1

Isomeric SMILES

C1=CC(=CNNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C(=O)C=C1

InChI

InChI=1S/C13H12N4O5S/c14-23(21,22)10-5-6-11(12(7-10)17(19)20)16-15-8-9-3-1-2-4-13(9)18/h1-8,15-16H,(H2,14,21,22)