6-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-2-propyl-pyridazin-3-one

Systemtic Name: 6-[2-(4-methoxyphenyl)azepan-1-yl]carbonyl-2-propyl-pyridazin-3-one Openeye Name: 6-[2-(4-methoxyphenyl)azepane-1-carbonyl]-2-propyl-pyridazin-3-one CAS Name: 6-[[2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]-2-propyl-3-pyridazinone IUPAC Name: 6-[2-(4-methoxyphenyl)azepane-1-carbonyl]-2-propylpyridazin-3-one Traditional Name: 6-[2-(4-methoxyphenyl)azepane-1-carbonyl]-2-propyl-pyridazin-3-one Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCCCCC2C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O3/c1-3-14-24-20(25)13-12-18(22-24)21(26)23-15-6-4-5-7-19(23)16-8-10-17(27-2)11-9-16/h8-13,19H,3-7,14-15H2,1-2H3