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

Systemtic Name: 2-(3-methylphenyl)-6-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(m-tolyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(3-methylphenyl)-6-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(3-methylphenyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(m-tolyl)-6-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O4/c1-16-3-2-4-19(15-16)26-21(28)10-9-20(23-26)22(29)25-13-11-24(12-14-25)17-5-7-18(8-6-17)27(30)31/h2-8,15H,9-14H2,1H3