tert-butyl 4-[[5-(3-fluorophenyl)pyridin-2-yl]carbamoyl-methyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-(3-fluorophenyl)pyridin-2-yl]carbamoyl-methyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(3-fluorophenyl)-2-pyridyl]carbamoyl-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[[[[5-(3-fluorophenyl)-2-pyridinyl]amino]-oxomethyl]-methylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-(3-fluorophenyl)pyridin-2-yl]carbamoyl-methylamino]piperidine-1-carboxylate Traditional Name: 4-[[5-(3-fluorophenyl)-2-pyridyl]carbamoyl-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H29FN4O3 MolecularWeight: 428.499763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(C)C(=O)NC2=NC=C(C=C2)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(C)C(=O)NC2=NC=C(C=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H29FN4O3/c1-23(2,3)31-22(30)28-12-10-19(11-13-28)27(4)21(29)26-20-9-8-17(15-25-20)16-6-5-7-18(24)14-16/h5-9,14-15,19H,10-13H2,1-4H3,(H,25,26,29)