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

Systemtic Name: 1-[1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-[[4-(2-furyl)phenyl]methyl]piperidin-1-ium-4-yl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[[4-(2-furanyl)phenyl]methyl]-4-piperidin-1-iumyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[[4-(furan-2-yl)phenyl]methyl]piperidin-1-ium-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[1-[4-(2-furyl)benzyl]piperidin-1-ium-4-yl]-N-isopropyl-piperidin-1-ium-4-carboxamide Formula: C25H37N3O2+2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C25H35N3O2/c1-19(2)26-25(29)22-9-15-28(16-10-22)23-11-13-27(14-12-23)18-20-5-7-21(8-6-20)24-4-3-17-30-24/h3-8,17,19,22-23H,9-16,18H2,1-2H3,(H,26,29)/p+2