(E)-3-(4-ethoxyphenyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]-3-p-phenetyl-acrylamide Formula: C24H31N2O2+ MolecularWeight: 379.51514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3

InChI

InChI=1S/C24H30N2O2/c1-2-28-23-13-10-20(11-14-23)12-15-24(27)25-18-21-8-4-5-9-22(21)19-26-16-6-3-7-17-26/h4-5,8-15H,2-3,6-7,16-19H2,1H3,(H,25,27)/p+1/b15-12+