(E)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-3-pyridin-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-3-pyridin-2-yl-prop-2-enamide Openeye Name: (E)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-3-(2-pyridyl)prop-2-enamide CAS Name: (E)-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethyl-3-(2-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-3-pyridin-2-ylprop-2-enamide Traditional Name: (E)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-3-(2-pyridyl)acrylamide Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)C=CC3=CC=CC=N3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=N3

InChI

InChI=1S/C23H29N3O/c1-25-16-12-21(13-17-25)19-26(18-14-20-7-3-2-4-8-20)23(27)11-10-22-9-5-6-15-24-22/h2-11,15,21H,12-14,16-19H2,1H3/p+1/b11-10+