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

Systemtic Name: [4-[[2-(2-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 4-chloranylbenzenesulfonate Openeye Name: [4-[[2-(o-tolyl)-5-oxo-oxazol-4-ylidene]methyl]phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [4-[[2-(2-methylphenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [4-[[2-(2-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [4-[[5-keto-2-(o-tolyl)-2-oxazolin-4-ylidene]methyl]phenyl] ester Formula: C23H16ClNO5S MolecularWeight: 453.89484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=CC3=CC=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl)C(=O)O2

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=CC3=CC=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl)C(=O)O2

InChI

InChI=1S/C23H16ClNO5S/c1-15-4-2-3-5-20(15)22-25-21(23(26)29-22)14-16-6-10-18(11-7-16)30-31(27,28)19-12-8-17(24)9-13-19/h2-14H,1H3