(Z)-2-cyano-3-[4-[2-(dimethylazaniumyl)ethoxy]-3-ethoxy-phenyl]prop-2-enoate

Systemtic Name: (Z)-2-cyano-3-[4-[2-(dimethylazaniumyl)ethoxy]-3-ethoxy-phenyl]prop-2-enoate Openeye Name: (Z)-2-cyano-3-[4-[2-(dimethylammonio)ethoxy]-3-ethoxy-phenyl]prop-2-enoate CAS Name: (Z)-2-cyano-3-[4-[2-(dimethylammonio)ethoxy]-3-ethoxyphenyl]-2-propenoate IUPAC Name: (Z)-2-cyano-3-[4-[2-(dimethylazaniumyl)ethoxy]-3-ethoxyphenyl]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[4-[2-(dimethylammonio)ethoxy]-3-ethoxy-phenyl]acrylate Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(/C#N)\C(=O)[O-])OCC[NH+](C)C

InChI

InChI=1S/C16H20N2O4/c1-4-21-15-10-12(9-13(11-17)16(19)20)5-6-14(15)22-8-7-18(2)3/h5-6,9-10H,4,7-8H2,1-3H3,(H,19,20)/b13-9-