methyl 4-(5-methyl-4-oxidanylidene-3-phenyl-[1,2]oxazolo[4,5-c]pyridin-6-yl)benzoate

Systemtic Name: methyl 4-(5-methyl-4-oxidanylidene-3-phenyl-[1,2]oxazolo[4,5-c]pyridin-6-yl)benzoate Openeye Name: methyl 4-(5-methyl-4-oxo-3-phenyl-isoxazolo[4,5-c]pyridin-6-yl)benzoate CAS Name: 4-(5-methyl-4-oxo-3-phenyl-6-isoxazolo[4,5-c]pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-methyl-4-oxo-3-phenyl-[1,2]oxazolo[4,5-c]pyridin-6-yl)benzoate Traditional Name: 4-(4-keto-5-methyl-3-phenyl-isoxazolo[4,5-c]pyridin-6-yl)benzoic acid methyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C1=O)C(=NO2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CN1C(=CC2=C(C1=O)C(=NO2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H16N2O4/c1-23-16(13-8-10-15(11-9-13)21(25)26-2)12-17-18(20(23)24)19(22-27-17)14-6-4-3-5-7-14/h3-12H,1-2H3