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

Systemtic Name: [(Z)-(5-methyl-4-oxidanylidene-2-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)amino] 4-chloranylbenzenesulfonate Openeye Name: [(Z)-(2-isopropyl-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [(Z)-(5-methyl-4-oxo-2-propan-2-yl-1-cyclohexa-2,5-dienylidene)amino] ester IUPAC Name: [(Z)-(5-methyl-4-oxo-2-propan-2-ylcyclohexa-2,5-dien-1-ylidene)amino] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [(Z)-(2-isopropyl-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C16H16ClNO4S MolecularWeight: 353.82054

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClNO4S/c1-10(2)14-9-16(19)11(3)8-15(14)18-22-23(20,21)13-6-4-12(17)5-7-13/h4-10H,1-3H3/b18-15-