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

Systemtic Name: 2-(3-methyl-7-oxidanylidene-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)butanoic acid Openeye Name: 2-(3-methyl-7-oxo-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)butanoic acid CAS Name: 2-(3-methyl-7-oxo-4-phenyl-6-isoxazolo[3,4-d]pyridazinyl)butanoic acid IUPAC Name: 2-(3-methyl-7-oxo-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)butanoic acid Traditional Name: 2-(7-keto-3-methyl-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)butyric acid Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4/c1-3-11(16(21)22)19-15(20)14-12(9(2)23-18-14)13(17-19)10-7-5-4-6-8-10/h4-8,11H,3H2,1-2H3,(H,21,22)