ethyl 4-oxidanylidene-5-(pyridin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5-(pyridin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Openeye Name: ethyl 4-oxo-5-(2-pyridylmethyl)isoxazolo[5,4-d]pyrimidine-3-carboxylate CAS Name: 4-oxo-5-(2-pyridinylmethyl)-3-isoxazolo[5,4-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-5-(pyridin-2-ylmethyl)-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate Traditional Name: 4-keto-5-(2-pyridylmethyl)isoxazolo[5,4-d]pyrimidine-3-carboxylic acid ethyl ester Formula: C14H12N4O4 MolecularWeight: 300.26948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC2=C1C(=O)N(C=N2)CC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=NOC2=C1C(=O)N(C=N2)CC3=CC=CC=N3

InChI

InChI=1S/C14H12N4O4/c1-2-21-14(20)11-10-12(22-17-11)16-8-18(13(10)19)7-9-5-3-4-6-15-9/h3-6,8H,2,7H2,1H3