6-(azepan-1-ylcarbonyl)-2-(3-chloranyl-4-methyl-phenyl)-4,5-dihydropyridazin-3-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-2-(3-chloranyl-4-methyl-phenyl)-4,5-dihydropyridazin-3-one Openeye Name: 6-(azepane-1-carbonyl)-2-(3-chloro-4-methyl-phenyl)-4,5-dihydropyridazin-3-one CAS Name: 6-[1-azepanyl(oxo)methyl]-2-(3-chloro-4-methylphenyl)-4,5-dihydropyridazin-3-one IUPAC Name: 6-(azepane-1-carbonyl)-2-(3-chloro-4-methylphenyl)-4,5-dihydropyridazin-3-one Traditional Name: 6-(azepane-1-carbonyl)-2-(3-chloro-4-methyl-phenyl)-4,5-dihydropyridazin-3-one Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C18H22ClN3O2/c1-13-6-7-14(12-15(13)19)22-17(23)9-8-16(20-22)18(24)21-10-4-2-3-5-11-21/h6-7,12H,2-5,8-11H2,1H3