tert-butyl 4-[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32FN3O3 MolecularWeight: 393.495483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC(C2=CC(=CC=C2)F)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NCC(C2=CC(=CC=C2)F)N(C)C

InChI

InChI=1S/C21H32FN3O3/c1-21(2,3)28-20(27)25-11-9-15(10-12-25)19(26)23-14-18(24(4)5)16-7-6-8-17(22)13-16/h6-8,13,15,18H,9-12,14H2,1-5H3,(H,23,26)