methyl 4-[[2-(3,5-dimethylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[[2-(3,5-dimethylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate Openeye Name: methyl 4-[[2-(3,5-dimethylphenyl)-5-oxo-oxazol-4-ylidene]methyl]benzoate CAS Name: 4-[[2-(3,5-dimethylphenyl)-5-oxo-4-oxazolylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3,5-dimethylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzoate Traditional Name: 4-[[2-(3,5-dimethylphenyl)-5-keto-2-oxazolin-4-ylidene]methyl]benzoic acid methyl ester Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2)C

InChI

InChI=1S/C20H17NO4/c1-12-8-13(2)10-16(9-12)18-21-17(20(23)25-18)11-14-4-6-15(7-5-14)19(22)24-3/h4-11H,1-3H3