tert-butyl 4-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[1-(difluoromethyl)benzimidazol-2-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[1-(difluoromethyl)-2-benzimidazolyl]methyl-methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[1-(difluoromethyl)benzimidazol-2-yl]methyl-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[1-(difluoromethyl)benzimidazol-2-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H28F2N4O3 MolecularWeight: 422.468826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=NC3=CC=CC=C3N2C(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=NC3=CC=CC=C3N2C(F)F

InChI

InChI=1S/C21H28F2N4O3/c1-21(2,3)30-20(29)26-11-9-14(10-12-26)18(28)25(4)13-17-24-15-7-5-6-8-16(15)27(17)19(22)23/h5-8,14,19H,9-13H2,1-4H3