Molecule ID: 122087

IUPAC Name: 3,5-dichloro-N-(1-chloro-3-methyl-2-oxopentan-3-yl)-4-methylbenzamide

Description: The molecule is a member of the class of benzamides obtained by formal condensation of the carboxy group of 3,5-dichloro-4-methylbenzamide with the amino group of 3-amino-1-chloro-3-methylpentan-2-one. It is a member of benzamides, an alpha-chloroketone and a dichlorobenzene.

SMILES: CCC(C)(N=C(O)c1cc(Cl)c(C)c(Cl)c1)C(=O)CCl

SELFIES: [C][C][C][Branch1][C][C][Branch2][Ring1][#Branch1][N][=C][Branch1][C][O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][=Branch1][C][=O][C][Cl]

InChI: InChI=1S/C14H16Cl3NO2/c1-4-14(3,12(19)7-15)18-13(20)9-5-10(16)8(2)11(17)6-9/h5-6H,4,7H2,1-3H3,(H,18,20)

Molecular Properties:
- Polar Surface Area: 46.2 Ų
- LogP: 4.3