(E)-3-(2-methoxy-5-methyl-phenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]prop-2-enamide

Systemtic Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]prop-2-enamide Openeye Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]prop-2-enamide CAS Name: (E)-3-(2-methoxy-5-methylphenyl)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-2-propenamide IUPAC Name: (E)-3-(2-methoxy-5-methylphenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]prop-2-enamide Traditional Name: (E)-3-(2-methoxy-5-methyl-phenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acrylamide Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C=CC2=C(C=CC(=C2)C)OC

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)/C=C/C2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C20H30N2O2/c1-16-8-10-19(24-3)18(15-16)9-11-20(23)21-12-6-14-22-13-5-4-7-17(22)2/h8-11,15,17H,4-7,12-14H2,1-3H3,(H,21,23)/p+1/b11-9+/t17-/m0/s1