Molecule ID: 2314

IUPAC Name: (2,2-dimethyl-1,3-benzodioxol-4-yl) N-methylcarbamate

Description: The molecule is a carbamate ester and a member of benzodioxoles. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a carbamate insecticide and an agrochemical. It derives from a methylcarbamic acid.

SMILES: CN=C(O)Oc1cccc2c1OC(C)(C)O2

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

InChI: InChI=1S/C11H13NO4/c1-11(2)15-8-6-4-5-7(9(8)16-11)14-10(13)12-3/h4-6H,1-3H3,(H,12,13)

Molecular Properties:
- Polar Surface Area: 56.8 Ų
- LogP: 1.7