3-(2-oxidanylidene-2-pyridin-3-yl-ethyl)-[1,2,4]triazino[3,4-a]phthalazin-4-one

Systemtic Name: 3-(2-oxidanylidene-2-pyridin-3-yl-ethyl)-[1,2,4]triazino[3,4-a]phthalazin-4-one Openeye Name: 3-[2-oxo-2-(3-pyridyl)ethyl]-[1,2,4]triazino[3,4-a]phthalazin-4-one CAS Name: 3-[2-oxo-2-(3-pyridinyl)ethyl]-[1,2,4]triazino[3,4-a]phthalazin-4-one IUPAC Name: 3-(2-oxo-2-pyridin-3-ylethyl)-[1,2,4]triazino[3,4-a]phthalazin-4-one Traditional Name: 3-[2-keto-2-(3-pyridyl)ethyl]-[1,2,4]triazino[3,4-a]phthalazin-4-one Formula: C17H11N5O2 MolecularWeight: 317.30154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN3C2=NN=C(C3=O)CC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=NN3C2=NN=C(C3=O)CC(=O)C4=CN=CC=C4

InChI

InChI=1S/C17H11N5O2/c23-15(12-5-3-7-18-9-12)8-14-17(24)22-16(21-20-14)13-6-2-1-4-11(13)10-19-22/h1-7,9-10H,8H2