N-[[3,4-bis(fluoranyl)phenyl]methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide

Systemtic Name: N-[[3,4-bis(fluoranyl)phenyl]methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide Openeye Name: N-[(3,4-difluorophenyl)methyl]-1-(1-isopropyl-4-piperidyl)piperidine-3-carboxamide CAS Name: N-[(3,4-difluorophenyl)methyl]-1-(1-propan-2-yl-4-piperidinyl)-3-piperidinecarboxamide IUPAC Name: N-[(3,4-difluorophenyl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide Traditional Name: N-(3,4-difluorobenzyl)-1-(1-isopropyl-4-piperidyl)nipecotamide Formula: C21H31F2N3O MolecularWeight: 379.487146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)N2CCCC(C2)C(=O)NCC3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C)N1CCC(CC1)N2CCCC(C2)C(=O)NCC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C21H31F2N3O/c1-15(2)25-10-7-18(8-11-25)26-9-3-4-17(14-26)21(27)24-13-16-5-6-19(22)20(23)12-16/h5-6,12,15,17-18H,3-4,7-11,13-14H2,1-2H3,(H,24,27)