4-(1,3-diethyl-2-oxidanylidene-imidazo[4,5-g]phthalazin-5-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(1,3-diethyl-2-oxidanylidene-imidazo[4,5-g]phthalazin-5-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide Openeye Name: 4-(1,3-diethyl-2-oxo-imidazo[4,5-g]phthalazin-5-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide CAS Name: 4-(1,3-diethyl-2-oxo-5-imidazo[4,5-g]phthalazinyl)-N-(4-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(1,3-diethyl-2-oxoimidazo[4,5-g]phthalazin-5-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide Traditional Name: 4-(1,3-diethyl-2-keto-imidazo[4,5-g]phthalazin-5-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide Formula: C24H26N8O4 MolecularWeight: 490.51444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C3C(=C2)C=NN=C3N4CCN(CC4)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-])N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C3C(=C2)C=NN=C3N4CCN(CC4)C(=O)NC5=CC=C(C=C5)[N+](=O)[O-])N(C1=O)CC

InChI

InChI=1S/C24H26N8O4/c1-3-30-20-13-16-15-25-27-22(19(16)14-21(20)31(4-2)24(30)34)28-9-11-29(12-10-28)23(33)26-17-5-7-18(8-6-17)32(35)36/h5-8,13-15H,3-4,9-12H2,1-2H3,(H,26,33)