[(4Z)-4-[1-(oxidanylamino)ethylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [(4Z)-4-[1-(oxidanylamino)ethylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 4-methylbenzenesulfonate Openeye Name: [(4Z)-4-[1-(hydroxyamino)ethylidene]-3-oxo-cyclohexa-1,5-dien-1-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(4Z)-4-[1-(hydroxyamino)ethylidene]-3-oxo-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [(4Z)-4-[1-(hydroxyamino)ethylidene]-3-oxocyclohexa-1,5-dien-1-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(4Z)-4-[1-(hydroxyamino)ethylidene]-3-keto-cyclohexa-1,5-dien-1-yl] ester Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)C(=C(C)NO)C=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)/C(=C(/C)\NO)/C=C2

InChI

InChI=1S/C15H15NO5S/c1-10-3-6-13(7-4-10)22(19,20)21-12-5-8-14(11(2)16-18)15(17)9-12/h3-9,16,18H,1-2H3/b14-11-