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

Systemtic Name: (E)-N-cyclopropyl-3-(4-methoxyphenyl)-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]prop-2-enamide Openeye Name: (E)-N-cyclopropyl-3-(4-methoxyphenyl)-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]prop-2-enamide CAS Name: (E)-N-cyclopropyl-3-(4-methoxyphenyl)-N-[[3-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methyl]-2-propenamide IUPAC Name: (E)-N-cyclopropyl-3-(4-methoxyphenyl)-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]prop-2-enamide Traditional Name: (E)-N-cyclopropyl-3-(4-methoxyphenyl)-N-[3-(2-piperidin-1-ium-1-ylethoxy)benzyl]acrylamide Formula: C27H35N2O3+ MolecularWeight: 435.5784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N(CC2=CC(=CC=C2)OCC[NH+]3CCCCC3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N(CC2=CC(=CC=C2)OCC[NH+]3CCCCC3)C4CC4

InChI

InChI=1S/C27H34N2O3/c1-31-25-13-8-22(9-14-25)10-15-27(30)29(24-11-12-24)21-23-6-5-7-26(20-23)32-19-18-28-16-3-2-4-17-28/h5-10,13-15,20,24H,2-4,11-12,16-19,21H2,1H3/p+1/b15-10+