4-[4-(dimethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one

Systemtic Name: 4-[4-(dimethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one Openeye Name: 4-[4-(dimethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one CAS Name: 4-[4-(dimethylamino)-3-nitrophenyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(dimethylamino)-3-nitrophenyl]-2H-phthalazin-1-one Traditional Name: 4-[4-(dimethylamino)-3-nitro-phenyl]-2H-phthalazin-1-one Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3/c1-19(2)13-8-7-10(9-14(13)20(22)23)15-11-5-3-4-6-12(11)16(21)18-17-15/h3-9H,1-2H3,(H,18,21)