2,2,2-tris(fluoranyl)ethyl 4-[(2-chloranyl-5-methoxycarbonyl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-[(2-chloranyl-5-methoxycarbonyl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 4-[(2-chloro-5-methoxycarbonyl-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[(2-chloro-5-methoxycarbonylanilino)-oxomethyl]-1-piperidinecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-[(2-chloro-5-methoxycarbonylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(5-carbomethoxy-2-chloro-phenyl)carbamoyl]piperidine-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C17H18ClF3N2O5 MolecularWeight: 422.78343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClF3N2O5/c1-27-15(25)11-2-3-12(18)13(8-11)22-14(24)10-4-6-23(7-5-10)16(26)28-9-17(19,20)21/h2-3,8,10H,4-7,9H2,1H3,(H,22,24)