2-(3-chloranyl-4-methyl-phenyl)-6-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-6-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(3-chloro-4-methyl-phenyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(3-chloro-4-methylphenyl)-6-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(3-chloro-4-methylphenyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(3-chloro-4-methyl-phenyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C22H22ClN5O4 MolecularWeight: 455.89418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN5O4/c1-15-2-3-18(14-19(15)23)27-21(29)9-8-20(24-27)22(30)26-12-10-25(11-13-26)16-4-6-17(7-5-16)28(31)32/h2-7,14H,8-13H2,1H3