(E)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-3-(2,4,5-trimethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(2,4,5-trimethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-asaryl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acrylamide Formula: C21H33N2O4+ MolecularWeight: 377.49772

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C=CC2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)/C=C/C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C21H32N2O4/c1-16-8-5-6-12-23(16)13-7-11-22-21(24)10-9-17-14-19(26-3)20(27-4)15-18(17)25-2/h9-10,14-16H,5-8,11-13H2,1-4H3,(H,22,24)/p+1/b10-9+/t16-/m0/s1