ethyl 2-(3-methyl-7-oxidanylidene-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)butanoate

Systemtic Name: ethyl 2-(3-methyl-7-oxidanylidene-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)butanoate Openeye Name: ethyl 2-(3-methyl-7-oxo-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)butanoate CAS Name: 2-(3-methyl-7-oxo-4-phenyl-6-isoxazolo[3,4-d]pyridazinyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-(3-methyl-7-oxo-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)butanoate Traditional Name: 2-(7-keto-3-methyl-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)butyric acid ethyl ester Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C(=O)C2=NOC(=C2C(=N1)C3=CC=CC=C3)C

Isomeric SMILES

CCC(C(=O)OCC)N1C(=O)C2=NOC(=C2C(=N1)C3=CC=CC=C3)C

InChI

InChI=1S/C18H19N3O4/c1-4-13(18(23)24-5-2)21-17(22)16-14(11(3)25-20-16)15(19-21)12-9-7-6-8-10-12/h6-10,13H,4-5H2,1-3H3