ethyl 2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-oxidanylidene-4-(pyridin-3-ylmethyl)phthalazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-oxo-4-(3-pyridylmethyl)phthalazin-2-yl]acetate CAS Name: 2-[1-oxo-4-(3-pyridinylmethyl)-2-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-oxo-4-(pyridin-3-ylmethyl)phthalazin-2-yl]acetate Traditional Name: 2-[1-keto-4-(3-pyridylmethyl)phthalazin-2-yl]acetic acid ethyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN=CC=C3

InChI

InChI=1S/C18H17N3O3/c1-2-24-17(22)12-21-18(23)15-8-4-3-7-14(15)16(20-21)10-13-6-5-9-19-11-13/h3-9,11H,2,10,12H2,1H3