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

Systemtic Name: [3-[[2-(2-chlorophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [3-[[2-(2-chlorophenyl)-5-oxo-oxazol-4-ylidene]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-[[2-(2-chlorophenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [3-[[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-[[2-(2-chlorophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]phenyl] ester Formula: C23H16ClNO5S MolecularWeight: 453.89484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C=C3C(=O)OC(=N3)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C=C3C(=O)OC(=N3)C4=CC=CC=C4Cl

InChI

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