3-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide

Systemtic Name: 3-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Openeye Name: 3-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide CAS Name: 3-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzenesulfonamide IUPAC Name: 3-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Traditional Name: 3-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]benzenesulfonamide Formula: C13H11N3O5S MolecularWeight: 321.30854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NC=C2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NC=C2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O5S/c14-22(20,21)12-3-1-2-10(7-12)15-8-9-6-11(16(18)19)4-5-13(9)17/h1-8,15H,(H2,14,20,21)