[[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino] benzenesulfonate

Systemtic Name: [[4-oxidanylidene-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino] benzenesulfonate Openeye Name: [(3,5-diisopropyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] benzenesulfonate CAS Name: benzenesulfonic acid [[4-oxo-3,5-di(propan-2-yl)-1-cyclohexa-2,5-dienylidene]amino] ester IUPAC Name: [[4-oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino] benzenesulfonate Traditional Name: benzenesulfonic acid [(3,5-diisopropyl-4-keto-cyclohexa-2,5-dien-1-ylidene)amino] ester Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NOS(=O)(=O)C2=CC=CC=C2)C=C(C1=O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=NOS(=O)(=O)C2=CC=CC=C2)C=C(C1=O)C(C)C

InChI

InChI=1S/C18H21NO4S/c1-12(2)16-10-14(11-17(13(3)4)18(16)20)19-23-24(21,22)15-8-6-5-7-9-15/h5-13H,1-4H3