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

Systemtic Name: N-(2-chloranyl-3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide Openeye Name: N-(2-chloro-3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide CAS Name: N-(2-chloro-3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-chloro-3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3-nitrobenzenesulfonamide Traditional Name: N-(2-chloro-4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)-3-nitro-benzenesulfonamide Formula: C14H11ClN2O5S MolecularWeight: 354.76554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=C(C1=O)C)Cl

Isomeric SMILES

CC1=CC(=NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=C(C1=O)C)Cl

InChI

InChI=1S/C14H11ClN2O5S/c1-8-6-12(13(15)9(2)14(8)18)16-23(21,22)11-5-3-4-10(7-11)17(19)20/h3-7H,1-2H3