[(E)-(5-chloranyl-2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate

Systemtic Name: [(E)-(5-chloranyl-2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate Openeye Name: [(E)-(5-chloro-2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate CAS Name: benzenesulfonic acid [(E)-(5-chloro-2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(5-chloro-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate Traditional Name: benzenesulfonic acid [(E)-(5-chloro-4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C13H10ClNO4S MolecularWeight: 311.7408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=CC(=O)C(=C/C1=N\OS(=O)(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C13H10ClNO4S/c1-9-7-13(16)11(14)8-12(9)15-19-20(17,18)10-5-3-2-4-6-10/h2-8H,1H3/b15-12+