1-[1-[[2,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[[2,4-bis(fluoranyl)phenyl]methyl]piperidin-1-ium-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-[(2,4-difluorophenyl)methyl]piperidin-1-ium-4-yl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(2,4-difluorophenyl)methyl]-4-piperidin-1-iumyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(2,4-difluorophenyl)methyl]piperidin-1-ium-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(2,4-difluorobenzyl)piperidin-1-ium-4-yl]-N-isopropyl-piperidin-1-ium-4-carboxamide Formula: C21H33F2N3O+2 MolecularWeight: 381.503026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C21H31F2N3O/c1-15(2)24-21(27)16-5-11-26(12-6-16)19-7-9-25(10-8-19)14-17-3-4-18(22)13-20(17)23/h3-4,13,15-16,19H,5-12,14H2,1-2H3,(H,24,27)/p+2