3-(3-methyl-4-oxidanylidene-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-5-yl)propanoic acid

Systemtic Name: 3-(3-methyl-4-oxidanylidene-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-5-yl)propanoic acid Openeye Name: 3-(3-methyl-4-oxo-7-phenyl-isoxazolo[4,5-d]pyridazin-5-yl)propanoic acid CAS Name: 3-(3-methyl-4-oxo-7-phenyl-5-isoxazolo[4,5-d]pyridazinyl)propanoic acid IUPAC Name: 3-(3-methyl-4-oxo-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-5-yl)propanoic acid Traditional Name: 3-(4-keto-3-methyl-7-phenyl-isoxazolo[4,5-d]pyridazin-5-yl)propionic acid Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C1C(=O)N(N=C2C3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC1=NOC2=C1C(=O)N(N=C2C3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C15H13N3O4/c1-9-12-14(22-17-9)13(10-5-3-2-4-6-10)16-18(15(12)21)8-7-11(19)20/h2-6H,7-8H2,1H3,(H,19,20)