3-[7,8,8-tris(chloranyl)-3,5-diethyl-4-methyl-octan-4-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[7,8,8-tris(chloranyl)-3,5-diethyl-4-methyl-octan-4-yl]-1H-pyridazin-6-one Openeye Name: 3-[4,5,5-trichloro-2-ethyl-1-(1-ethylpropyl)-1-methyl-pentyl]-1H-pyridazin-6-one CAS Name: 3-(7,8,8-trichloro-3,5-diethyl-4-methyloctan-4-yl)-1H-pyridazin-6-one IUPAC Name: 3-(7,8,8-trichloro-3,5-diethyl-4-methyloctan-4-yl)-1H-pyridazin-6-one Traditional Name: 3-[4,5,5-trichloro-2-ethyl-1-(1-ethylpropyl)-1-methyl-pentyl]-1H-pyridazin-6-one Formula: C17H27Cl3N2O MolecularWeight: 381.76808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C)(C1=NNC(=O)C=C1)C(CC)CC(C(Cl)Cl)Cl

Isomeric SMILES

CCC(CC)C(C)(C1=NNC(=O)C=C1)C(CC)CC(C(Cl)Cl)Cl

InChI

InChI=1S/C17H27Cl3N2O/c1-5-11(6-2)17(4,14-8-9-15(23)22-21-14)12(7-3)10-13(18)16(19)20/h8-9,11-13,16H,5-7,10H2,1-4H3,(H,22,23)