tert-butyl 4-[[5-chloranyl-6-(3-fluorophenyl)pyridin-3-yl]carbamoyl-methyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-chloranyl-6-(3-fluorophenyl)pyridin-3-yl]carbamoyl-methyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-chloro-6-(3-fluorophenyl)-3-pyridyl]carbamoyl-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[[[[5-chloro-6-(3-fluorophenyl)-3-pyridinyl]amino]-oxomethyl]-methylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-chloro-6-(3-fluorophenyl)pyridin-3-yl]carbamoyl-methylamino]piperidine-1-carboxylate Traditional Name: 4-[[5-chloro-6-(3-fluorophenyl)-3-pyridyl]carbamoyl-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H28ClFN4O3 MolecularWeight: 462.944823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClFN4O3/c1-23(2,3)32-22(31)29-10-8-18(9-11-29)28(4)21(30)27-17-13-19(24)20(26-14-17)15-6-5-7-16(25)12-15/h5-7,12-14,18H,8-11H2,1-4H3,(H,27,30)