3-[(4-chloranyl-3-pentan-3-yloxy-phenyl)methyl]-1H-pyridazin-6-one

Systemtic Name: 3-[(4-chloranyl-3-pentan-3-yloxy-phenyl)methyl]-1H-pyridazin-6-one Openeye Name: 3-[[4-chloro-3-(1-ethylpropoxy)phenyl]methyl]-1H-pyridazin-6-one CAS Name: 3-[(4-chloro-3-pentan-3-yloxyphenyl)methyl]-1H-pyridazin-6-one IUPAC Name: 3-[(4-chloro-3-pentan-3-yloxyphenyl)methyl]-1H-pyridazin-6-one Traditional Name: 3-[4-chloro-3-(1-ethylpropoxy)benzyl]-1H-pyridazin-6-one Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=C(C=CC(=C1)CC2=NNC(=O)C=C2)Cl

Isomeric SMILES

CCC(CC)OC1=C(C=CC(=C1)CC2=NNC(=O)C=C2)Cl

InChI

InChI=1S/C16H19ClN2O2/c1-3-13(4-2)21-15-10-11(5-7-14(15)17)9-12-6-8-16(20)19-18-12/h5-8,10,13H,3-4,9H2,1-2H3,(H,19,20)