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

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]acrylamide Formula: C23H29N2O2+ MolecularWeight: 365.48856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C23H28N2O2/c1-27-22-12-9-19(10-13-22)11-14-23(26)24-17-20-5-7-21(8-6-20)18-25-15-3-2-4-16-25/h5-14H,2-4,15-18H2,1H3,(H,24,26)/p+1/b14-11+