4-[[(E)-(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenesulfonamide

Systemtic Name: 4-[[(E)-(3-chloranyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenesulfonamide Openeye Name: 4-[[(E)-(3-chloro-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenesulfonamide CAS Name: 4-[[(E)-(3-chloro-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzenesulfonamide IUPAC Name: 4-[[(E)-(3-chloro-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenesulfonamide Traditional Name: 4-[[(E)-(3-chloro-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzenesulfonamide Formula: C13H10ClN3O5S MolecularWeight: 355.7536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=C2C=C(C=C(C2=O)[N+](=O)[O-])Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1N/C=C/2\C=C(C=C(C2=O)[N+](=O)[O-])Cl)S(=O)(=O)N

InChI

InChI=1S/C13H10ClN3O5S/c14-9-5-8(13(18)12(6-9)17(19)20)7-16-10-1-3-11(4-2-10)23(15,21)22/h1-7,16H,(H2,15,21,22)/b8-7+