2,2,2-tris(fluoranyl)ethyl 4-[(4-acetamido-3-methyl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-[(4-acetamido-3-methyl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 4-[(4-acetamido-3-methyl-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[(4-acetamido-3-methylanilino)-oxomethyl]-1-piperidinecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-[(4-acetamido-3-methylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(4-acetamido-3-methyl-phenyl)carbamoyl]piperidine-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C18H22F3N3O4 MolecularWeight: 401.38019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)OCC(F)(F)F)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)OCC(F)(F)F)NC(=O)C

InChI

InChI=1S/C18H22F3N3O4/c1-11-9-14(3-4-15(11)22-12(2)25)23-16(26)13-5-7-24(8-6-13)17(27)28-10-18(19,20)21/h3-4,9,13H,5-8,10H2,1-2H3,(H,22,25)(H,23,26)