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

Systemtic Name: [(E)-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 4-bromanylbenzenesulfonate Openeye Name: [(E)-(2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [(E)-(2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [(E)-(4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C13H10BrNO4S MolecularWeight: 356.1918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10BrNO4S/c1-9-8-11(16)4-7-13(9)15-19-20(17,18)12-5-2-10(14)3-6-12/h2-8H,1H3/b15-13+