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

Systemtic Name: (NE)-N-(3-bromanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-4-nitro-benzenesulfonamide Openeye Name: (NE)-N-(3-bromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-4-nitro-benzenesulfonamide CAS Name: (NE)-N-(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)-4-nitrobenzenesulfonamide IUPAC Name: (NE)-N-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-4-nitrobenzenesulfonamide Traditional Name: (NE)-N-(3-bromo-4-keto-cyclohexa-2,5-dien-1-ylidene)-4-nitro-benzenesulfonamide Formula: C12H7BrN2O5S MolecularWeight: 371.16338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7BrN2O5S/c13-11-7-8(1-6-12(11)16)14-21(19,20)10-4-2-9(3-5-10)15(17)18/h1-7H/b14-8+