[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-oxidanylidenechromene-3-carboxylate Openeye Name: [5-(p-tolyl)isoxazol-3-yl]methyl 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [5-(4-methylphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [5-(p-tolyl)isoxazol-3-yl]methyl ester Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H15NO5/c1-13-6-8-14(9-7-13)19-11-16(22-27-19)12-25-20(23)17-10-15-4-2-3-5-18(15)26-21(17)24/h2-11H,12H2,1H3