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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCN(CC2)C(=O)OCC(F)(F)F

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCN(CC2)C(=O)OCC(F)(F)F

InChI

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