Molecule ID: 443067

IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] N-phenylcarbamate

Description: The molecule is a carbamate ester obtained by the formal condensation of phenylcarbamic acid with the hydroxy group of N-ethyl-2-hydroxypropanamide. It has a role as a xenobiotic, an environmental contaminant and a herbicide. It is a carbamate ester and a monocarboxylic acid amide. It derives from a phenylcarbamic acid.

SMILES: CCN=C(O)[C@H](C)OC(O)=Nc1ccccc1

SELFIES: [C][C][N][=C][Branch1][C][O][C@H1][Branch1][C][C][O][C][Branch1][C][O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 67.4 Ų
- LogP: 1.6