(E)-3-(2-methoxy-5-methyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Openeye Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide CAS Name: (E)-3-(2-methoxy-5-methylphenyl)-N-(1-propyl-4-piperidin-1-iumyl)-2-propenamide IUPAC Name: (E)-3-(2-methoxy-5-methylphenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Traditional Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)acrylamide Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C=CC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)/C=C/C2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C19H28N2O2/c1-4-11-21-12-9-17(10-13-21)20-19(22)8-6-16-14-15(2)5-7-18(16)23-3/h5-8,14,17H,4,9-13H2,1-3H3,(H,20,22)/p+1/b8-6+