2-(2,5-dimethylphenyl)-6-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(2,5-dimethylphenyl)-6-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(2,5-dimethylphenyl)-6-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(2,5-dimethylphenyl)-6-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(2,5-dimethylphenyl)-6-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(2,5-dimethylphenyl)-6-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C22H24N6O4 MolecularWeight: 436.46376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N6O4/c1-15-3-4-16(2)19(13-15)27-21(29)8-6-18(24-27)22(30)26-11-9-25(10-12-26)17-5-7-20(23-14-17)28(31)32/h3-5,7,13-14H,6,8-12H2,1-2H3