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

Systemtic Name: ethyl 2-(3-methyl-7-oxidanylidene-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)pentanoate Openeye Name: ethyl 2-(3-methyl-7-oxo-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)pentanoate CAS Name: 2-(3-methyl-7-oxo-4-phenyl-6-isoxazolo[3,4-d]pyridazinyl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-(3-methyl-7-oxo-4-phenyl-[1,2]oxazolo[3,4-d]pyridazin-6-yl)pentanoate Traditional Name: 2-(7-keto-3-methyl-4-phenyl-isoxazolo[3,4-d]pyridazin-6-yl)valeric acid ethyl ester Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4/c1-4-9-14(19(24)25-5-2)22-18(23)17-15(12(3)26-21-17)16(20-22)13-10-7-6-8-11-13/h6-8,10-11,14H,4-5,9H2,1-3H3