(2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) (E)-3-phenylprop-2-enoate chloride

Systemtic Name: (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) (E)-3-phenylprop-2-enoate chloride Openeye Name: (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) (E)-3-phenylprop-2-enoate chloride CAS Name: (E)-3-phenyl-2-propenoic acid [2,2-dimethyl-3-(4-morpholin-4-iumyl)propyl] ester chloride IUPAC Name: (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) (E)-3-phenylprop-2-enoate chloride Traditional Name: (E)-3-phenylacrylic acid (2,2-dimethyl-3-morpholin-4-ium-4-yl-propyl) ester chloride Formula: C18H26ClNO3 MolecularWeight: 339.85694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCOCC1)COC(=O)C=CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC(C)(C[NH+]1CCOCC1)COC(=O)/C=C/C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C18H25NO3.ClH/c1-18(2,14-19-10-12-21-13-11-19)15-22-17(20)9-8-16-6-4-3-5-7-16;/h3-9H,10-15H2,1-2H3;1H/b9-8+;