2-nitro-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]benzamide

Systemtic Name: 2-nitro-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]benzamide Openeye Name: 2-nitro-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide CAS Name: 2-nitro-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide IUPAC Name: 2-nitro-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide Traditional Name: N-[(4-keto-3H-phthalazin-1-yl)methyl]-2-nitro-benzamide Formula: C16H12N4O4 MolecularWeight: 324.29088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CNC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CNC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4/c21-15(12-7-3-4-8-14(12)20(23)24)17-9-13-10-5-1-2-6-11(10)16(22)19-18-13/h1-8H,9H2,(H,17,21)(H,19,22)