(E)-3-(furan-2-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(furan-2-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]acrylamide Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C=CC3=CC=CO3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)/C=C/C3=CC=CO3

InChI

InChI=1S/C20H24N2O2/c23-20(11-10-19-9-6-14-24-19)21-15-17-7-2-3-8-18(17)16-22-12-4-1-5-13-22/h2-3,6-11,14H,1,4-5,12-13,15-16H2,(H,21,23)/p+1/b11-10+