(1-methylpiperidin-1-ium-3-yl) (E)-3-(4-methoxyphenyl)prop-2-enoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-3-yl) (E)-3-(4-methoxyphenyl)prop-2-enoate chloride Openeye Name: (1-methylpiperidin-1-ium-3-yl) (E)-3-(4-methoxyphenyl)prop-2-enoate chloride CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid (1-methyl-3-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-3-yl) (E)-3-(4-methoxyphenyl)prop-2-enoate chloride Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid (1-methylpiperidin-1-ium-3-yl) ester chloride Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)C=CC2=CC=C(C=C2)OC.[Cl-]

Isomeric SMILES

C[NH+]1CCCC(C1)OC(=O)/C=C/C2=CC=C(C=C2)OC.[Cl-]

InChI

InChI=1S/C16H21NO3.ClH/c1-17-11-3-4-15(12-17)20-16(18)10-7-13-5-8-14(19-2)9-6-13;/h5-10,15H,3-4,11-12H2,1-2H3;1H/b10-7+;