[2-[[2-(4-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 4-acetamidobenzenesulfonate

Systemtic Name: [2-[[2-(4-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Openeye Name: [2-[[5-oxo-2-(p-tolyl)oxazol-4-ylidene]methyl]phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [2-[[2-(4-methylphenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [2-[[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [2-[[5-keto-2-(p-tolyl)-2-oxazolin-4-ylidene]methyl]phenyl] ester Formula: C25H20N2O6S MolecularWeight: 476.5011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CC3=CC=CC=C3OS(=O)(=O)C4=CC=C(C=C4)NC(=O)C)C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CC3=CC=CC=C3OS(=O)(=O)C4=CC=C(C=C4)NC(=O)C)C(=O)O2

InChI

InChI=1S/C25H20N2O6S/c1-16-7-9-18(10-8-16)24-27-22(25(29)32-24)15-19-5-3-4-6-23(19)33-34(30,31)21-13-11-20(12-14-21)26-17(2)28/h3-15H,1-2H3,(H,26,28)