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

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C21H14FNO5 MolecularWeight: 379.337963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)C2=CC(=O)C3=CC=CC=C3O2)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)C2=CC(=O)C3=CC=CC=C3O2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14FNO5/c1-12-16(23-28-20(12)13-6-8-14(22)9-7-13)11-26-21(25)19-10-17(24)15-4-2-3-5-18(15)27-19/h2-10H,11H2,1H3