N-(2,4-dimethyl-5-nitro-phenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(2,4-dimethyl-5-nitrophenyl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(2,4-dimethyl-5-nitrophenyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(2,4-dimethyl-5-nitro-phenyl)-4-keto-3H-phthalazine-1-carboxamide Formula: C17H14N4O4 MolecularWeight: 338.31746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N4O4/c1-9-7-10(2)14(21(24)25)8-13(9)18-17(23)15-11-5-3-4-6-12(11)16(22)20-19-15/h3-8H,1-2H3,(H,18,23)(H,20,22)