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

Systemtic Name: [2-[(E)-(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-[(E)-(5-oxo-2-phenyl-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[(E)-(5-oxo-2-phenyl-4-oxazolylidene)methyl]phenyl] ester IUPAC Name: [2-[(E)-(5-oxo-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[(E)-(5-keto-2-phenyl-2-oxazolin-4-ylidene)methyl]phenyl] ester Formula: C23H17NO5S MolecularWeight: 419.44978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=C3C(=O)OC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2/C=C/3\C(=O)OC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H17NO5S/c1-16-11-13-19(14-12-16)30(26,27)29-21-10-6-5-9-18(21)15-20-23(25)28-22(24-20)17-7-3-2-4-8-17/h2-15H,1H3/b20-15+