6-(azepan-1-ylcarbonyl)-5-methoxy-2-(2-methylphenyl)pyridazin-3-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-5-methoxy-2-(2-methylphenyl)pyridazin-3-one Openeye Name: 6-(azepane-1-carbonyl)-5-methoxy-2-(o-tolyl)pyridazin-3-one CAS Name: 6-[1-azepanyl(oxo)methyl]-5-methoxy-2-(2-methylphenyl)-3-pyridazinone IUPAC Name: 6-(azepane-1-carbonyl)-5-methoxy-2-(2-methylphenyl)pyridazin-3-one Traditional Name: 6-(azepane-1-carbonyl)-5-methoxy-2-(o-tolyl)pyridazin-3-one Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C=C(C(=N2)C(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C=C(C(=N2)C(=O)N3CCCCCC3)OC

InChI

InChI=1S/C19H23N3O3/c1-14-9-5-6-10-15(14)22-17(23)13-16(25-2)18(20-22)19(24)21-11-7-3-4-8-12-21/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3