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

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3-nitrophenyl)propanamide Openeye Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)propanamide CAS Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)propanamide IUPAC Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)propanamide Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)-N-(3-nitrophenyl)propionamide Formula: C17H14N4O5 MolecularWeight: 354.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O5/c22-15(18-11-4-3-5-12(10-11)21(25)26)8-9-20-17(24)14-7-2-1-6-13(14)16(23)19-20/h1-7,10H,8-9H2,(H,18,22)(H,19,23)