[1-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate

Systemtic Name: [1-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate Openeye Name: [2-[2-chloro-5-(trifluoromethyl)anilino]-1-methyl-2-oxo-ethyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [1-[2-chloro-5-(trifluoromethyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[2-chloro-5-(trifluoromethyl)anilino]-1-oxopropan-2-yl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[2-chloro-5-(trifluoromethyl)anilino]-2-keto-1-methyl-ethyl] ester Formula: C18H15ClF3NO3 MolecularWeight: 385.76481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC(C)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C18H15ClF3NO3/c1-10-4-3-5-12(8-10)17(25)26-11(2)16(24)23-15-9-13(18(20,21)22)6-7-14(15)19/h3-9,11H,1-2H3,(H,23,24)