(E)-3-[3-chloranyl-4-[2-(dimethylazaniumyl)ethoxy]-5-ethoxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[3-chloranyl-4-[2-(dimethylazaniumyl)ethoxy]-5-ethoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-ethoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-ethoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[3-chloro-4-[2-(dimethylazaniumyl)ethoxy]-5-ethoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-ethoxy-phenyl]acrylate Formula: C15H20ClNO4 MolecularWeight: 313.7766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClNO4/c1-4-20-13-10-11(5-6-14(18)19)9-12(16)15(13)21-8-7-17(2)3/h5-6,9-10H,4,7-8H2,1-3H3,(H,18,19)/b6-5+