N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-3,5-dimethyl-benzamide Openeye Name: N-[[1-(2-furylmethyl)piperidin-1-ium-4-yl]methyl]-3,5-dimethyl-benzamide CAS Name: N-[[1-(2-furanylmethyl)-4-piperidin-1-iumyl]methyl]-3,5-dimethylbenzamide IUPAC Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-3,5-dimethylbenzamide Traditional Name: N-[[1-(2-furfuryl)piperidin-1-ium-4-yl]methyl]-3,5-dimethyl-benzamide Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)C

InChI

InChI=1S/C20H26N2O2/c1-15-10-16(2)12-18(11-15)20(23)21-13-17-5-7-22(8-6-17)14-19-4-3-9-24-19/h3-4,9-12,17H,5-8,13-14H2,1-2H3,(H,21,23)/p+1