3-(azepan-1-ylcarbonyl)-1-(4-chlorophenyl)-6-methyl-pyridazin-4-one

Systemtic Name: 3-(azepan-1-ylcarbonyl)-1-(4-chlorophenyl)-6-methyl-pyridazin-4-one Openeye Name: 3-(azepane-1-carbonyl)-1-(4-chlorophenyl)-6-methyl-pyridazin-4-one CAS Name: 3-[1-azepanyl(oxo)methyl]-1-(4-chlorophenyl)-6-methyl-4-pyridazinone IUPAC Name: 3-(azepane-1-carbonyl)-1-(4-chlorophenyl)-6-methylpyridazin-4-one Traditional Name: 3-(azepane-1-carbonyl)-1-(4-chlorophenyl)-6-methyl-pyridazin-4-one Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C18H20ClN3O2/c1-13-12-16(23)17(18(24)21-10-4-2-3-5-11-21)20-22(13)15-8-6-14(19)7-9-15/h6-9,12H,2-5,10-11H2,1H3