2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)acetamide Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N4O5/c21-14(17-10-4-3-5-11(8-10)20(24)25)9-19-16(23)13-7-2-1-6-12(13)15(22)18-19/h1-8H,9H2,(H,17,21)(H,18,22)