2,2,2-tris(fluoranyl)ethyl 4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)piperidine-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)piperidine-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)piperidine-1-carboxylate CAS Name: 4-[(1,2-dihydroacenaphthylen-5-ylamino)-oxomethyl]-1-piperidinecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-(1,2-dihydroacenaphthylen-5-ylcarbamoyl)piperidine-1-carboxylate Traditional Name: 4-(acenaphthen-5-ylcarbamoyl)piperidine-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C21H21F3N2O3 MolecularWeight: 406.39825

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C3C=CC=C4C3=C(CC4)C=C2)C(=O)OCC(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C3C=CC=C4C3=C(CC4)C=C2)C(=O)OCC(F)(F)F

InChI

InChI=1S/C21H21F3N2O3/c22-21(23,24)12-29-20(28)26-10-8-15(9-11-26)19(27)25-17-7-6-14-5-4-13-2-1-3-16(17)18(13)14/h1-3,6-7,15H,4-5,8-12H2,(H,25,27)