1-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-4-yl]-N-cyclopropyl-piperidine-3-carboxamide

Systemtic Name: 1-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperidin-4-yl]-N-cyclopropyl-piperidine-3-carboxamide Openeye Name: 1-[1-[(4-chloro-3-fluoro-phenyl)methyl]-4-piperidyl]-N-cyclopropyl-piperidine-3-carboxamide CAS Name: 1-[1-[(4-chloro-3-fluorophenyl)methyl]-4-piperidinyl]-N-cyclopropyl-3-piperidinecarboxamide IUPAC Name: 1-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]-N-cyclopropylpiperidine-3-carboxamide Traditional Name: 1-[1-(4-chloro-3-fluoro-benzyl)-4-piperidyl]-N-cyclopropyl-nipecotamide Formula: C21H29ClFN3O MolecularWeight: 393.925863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCN(CC2)CC3=CC(=C(C=C3)Cl)F)C(=O)NC4CC4

Isomeric SMILES

C1CC(CN(C1)C2CCN(CC2)CC3=CC(=C(C=C3)Cl)F)C(=O)NC4CC4

InChI

InChI=1S/C21H29ClFN3O/c22-19-6-3-15(12-20(19)23)13-25-10-7-18(8-11-25)26-9-1-2-16(14-26)21(27)24-17-4-5-17/h3,6,12,16-18H,1-2,4-5,7-11,13-14H2,(H,24,27)