[2-bromanyl-6-methoxy-4-[(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-bromanyl-6-methoxy-4-[(5-oxidanylidene-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-bromo-6-methoxy-4-[(5-oxo-2-phenyl-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-bromo-6-methoxy-4-[(5-oxo-2-phenyl-4-oxazolylidene)methyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-[(5-oxo-2-phenyl-1,3-oxazol-4-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-bromo-4-[(5-keto-2-phenyl-2-oxazolin-4-ylidene)methyl]-6-methoxy-phenyl] ester Formula: C24H18BrNO6S MolecularWeight: 528.37182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=C3C(=O)OC(=N3)C4=CC=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=C3C(=O)OC(=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H18BrNO6S/c1-15-8-10-18(11-9-15)33(28,29)32-22-19(25)12-16(14-21(22)30-2)13-20-24(27)31-23(26-20)17-6-4-3-5-7-17/h3-14H,1-2H3