[(E)-(5-bromanyl-2,3-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate

Systemtic Name: [(E)-(5-bromanyl-2,3-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate Openeye Name: [(E)-(5-bromo-2,3-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate CAS Name: benzenesulfonic acid [(E)-(5-bromo-2,3-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(E)-(5-bromo-2,3-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate Traditional Name: benzenesulfonic acid [(E)-(5-bromo-4-keto-2,3-dimethyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C14H12BrNO4S MolecularWeight: 370.21838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BrNO4S/c1-9-10(2)14(17)12(15)8-13(9)16-20-21(18,19)11-6-4-3-5-7-11/h3-8H,1-2H3/b16-13+