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

Systemtic Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-[[1-(2-furylmethyl)piperidin-1-ium-4-yl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-[[1-(2-furanylmethyl)-4-piperidin-1-iumyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-[[1-(2-furfuryl)piperidin-1-ium-4-yl]methyl]-3,4-dimethoxy-benzamide Formula: C20H27N2O4+ MolecularWeight: 359.43938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)OC

InChI

InChI=1S/C20H26N2O4/c1-24-18-6-5-16(12-19(18)25-2)20(23)21-13-15-7-9-22(10-8-15)14-17-4-3-11-26-17/h3-6,11-12,15H,7-10,13-14H2,1-2H3,(H,21,23)/p+1