[4-[[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] 2-methylbenzoate

Systemtic Name: [4-[[2-(4-bromophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] 2-methylbenzoate Openeye Name: [4-[[2-(4-bromophenyl)-5-oxo-oxazol-4-ylidene]methyl]-2-methoxy-phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-[[2-(4-bromophenyl)-5-oxo-4-oxazolylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-[[2-(4-bromophenyl)-5-keto-2-oxazolin-4-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C25H18BrNO5 MolecularWeight: 492.31812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C25H18BrNO5/c1-15-5-3-4-6-19(15)24(28)31-21-12-7-16(14-22(21)30-2)13-20-25(29)32-23(27-20)17-8-10-18(26)11-9-17/h3-14H,1-2H3