[(Z)-(2,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 4-chloranylbenzenesulfonate

Systemtic Name: [(Z)-(2,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 4-chloranylbenzenesulfonate Openeye Name: [(Z)-(2,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [(Z)-(2,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(Z)-(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [(Z)-(4-keto-2,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C14H12ClNO4S MolecularWeight: 325.76738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NOS(=O)(=O)C2=CC=C(C=C2)Cl)C(=CC1=O)C

Isomeric SMILES

CC1=C/C(=N/OS(=O)(=O)C2=CC=C(C=C2)Cl)/C(=CC1=O)C

InChI

InChI=1S/C14H12ClNO4S/c1-9-8-14(17)10(2)7-13(9)16-20-21(18,19)12-5-3-11(15)4-6-12/h3-8H,1-2H3/b16-13-