(E)-3-[4-[3-(dimethylazaniumyl)propoxy]-3-ethoxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[3-(dimethylazaniumyl)propoxy]-3-ethoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[4-[3-(dimethylammonio)propoxy]-3-ethoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-[3-(dimethylammonio)propoxy]-3-ethoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[4-[3-(dimethylazaniumyl)propoxy]-3-ethoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-[3-(dimethylammonio)propoxy]-3-ethoxy-phenyl]acrylate Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)[O-])OCCC[NH+](C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)[O-])OCCC[NH+](C)C

InChI

InChI=1S/C16H23NO4/c1-4-20-15-12-13(7-9-16(18)19)6-8-14(15)21-11-5-10-17(2)3/h6-9,12H,4-5,10-11H2,1-3H3,(H,18,19)/b9-7+