Molecule ID: 54708610

IUPAC Name: 3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one

Description: The molecule is an azaspiro compound that is spirotetramat in which the carbonate ester group has been hydrolysed to the corresponding hydroxy group. It is the active insecticide of the proinsecticicde spirotetramat. It has a role as an agrochemical, an EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor and an insecticide. It is an azaspiro compound, a member of benzenes, an organic hydroxy compound, an enol, a member of tetramic acids and an ether.

SMILES: COC1CCC2(CC1)N=C(O)C(c1cc(C)ccc1C)=C2O

SELFIES: [C][O][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][=C][Branch1][C][O][C][Branch1][=N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][=C][Ring1][S][O]

InChI: InChI=1S/C18H23NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,20H,6-9H2,1-3H3,(H,19,21)

Molecular Properties:
- Polar Surface Area: 58.6 Ų
- LogP: 2.4