N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,2-dimethyl-furan-3-carboxamide

Systemtic Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,2-dimethyl-furan-3-carboxamide Openeye Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,2-dimethyl-furan-3-carboxamide CAS Name: N-[[1-[2-(4-chlorophenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N,2-dimethyl-3-furancarboxamide IUPAC Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,2-dimethylfuran-3-carboxamide Traditional Name: N-[[1-[2-(4-chlorophenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N,2-dimethyl-3-furamide Formula: C21H28ClN2O2+ MolecularWeight: 375.91222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CO1)C(=O)N(C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H27ClN2O2/c1-16-20(10-14-26-16)21(25)23(2)15-18-8-12-24(13-9-18)11-7-17-3-5-19(22)6-4-17/h3-6,10,14,18H,7-9,11-13,15H2,1-2H3/p+1