(NE)-N-(3-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide

Systemtic Name: (NE)-N-(3-chloranyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide Openeye Name: (NE)-N-(3-chloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide CAS Name: (NE)-N-(3-chloro-4-oxo-1-cyclohexa-2,5-dienylidene)-3-nitrobenzenesulfonamide IUPAC Name: (NE)-N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)-3-nitrobenzenesulfonamide Traditional Name: (NE)-N-(3-chloro-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide Formula: C12H7ClN2O5S MolecularWeight: 326.71238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)/N=C/2\C=CC(=O)C(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H7ClN2O5S/c13-11-6-8(4-5-12(11)16)14-21(19,20)10-3-1-2-9(7-10)15(17)18/h1-7H/b14-8+