2-[4-(3-nitrophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[4-(3-nitrophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[4-(3-nitrophenyl)-1-oxo-phthalazin-2-yl]-N-(3-pyridyl)acetamide CAS Name: 2-[4-(3-nitrophenyl)-1-oxo-2-phthalazinyl]-N-(3-pyridinyl)acetamide IUPAC Name: 2-[4-(3-nitrophenyl)-1-oxophthalazin-2-yl]-N-pyridin-3-ylacetamide Traditional Name: 2-[1-keto-4-(3-nitrophenyl)phthalazin-2-yl]-N-(3-pyridyl)acetamide Formula: C21H15N5O4 MolecularWeight: 401.3749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CN=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=CN=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O4/c27-19(23-15-6-4-10-22-12-15)13-25-21(28)18-9-2-1-8-17(18)20(24-25)14-5-3-7-16(11-14)26(29)30/h1-12H,13H2,(H,23,27)