Molecule ID: 47898

IUPAC Name: N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide

Description: The molecule is a member of the class of benzamides, obtained by formal condensation of the carboxy group of 2-(trifluoromethyl)benzoic acid with the amino group of 3-(ispropyloxy)aniline. A fungicide used to control a range of pathogens especially Rhizoctonia spp. on rice, turf and other crops. It has a role as an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor and an antifungal agrochemical. It is a member of benzamides, an aromatic ether, a member of (trifluoromethyl)benzenes and a benzanilide fungicide.

SMILES: CC(C)Oc1cccc(N=C(O)c2ccccc2C(F)(F)F)c1

SELFIES: [C][C][Branch1][C][C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch1][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring1][Ring1]

InChI: InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)

Molecular Properties:
- Polar Surface Area: 38.3 Ų
- LogP: 3.7