ethyl 4-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)butanoate

Systemtic Name: ethyl 4-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)butanoate Openeye Name: ethyl 4-[1-oxo-4-(3-pyridyl)phthalazin-2-yl]butanoate CAS Name: 4-[1-oxo-4-(3-pyridinyl)-2-phthalazinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-(1-oxo-4-pyridin-3-ylphthalazin-2-yl)butanoate Traditional Name: 4-[1-keto-4-(3-pyridyl)phthalazin-2-yl]butyric acid ethyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)C2=CC=CC=C2C(=N1)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CCCN1C(=O)C2=CC=CC=C2C(=N1)C3=CN=CC=C3

InChI

InChI=1S/C19H19N3O3/c1-2-25-17(23)10-6-12-22-19(24)16-9-4-3-8-15(16)18(21-22)14-7-5-11-20-13-14/h3-5,7-9,11,13H,2,6,10,12H2,1H3