(Z)-3-[3-chloranyl-4-[2-(diethylazaniumyl)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-[3-chloranyl-4-[2-(diethylazaniumyl)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: (Z)-3-[3-chloro-4-[2-(diethylammonio)ethoxy]-5-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[3-chloro-4-[2-(diethylammonio)ethoxy]-5-methoxyphenyl]-2-cyano-2-propenoate IUPAC Name: (Z)-3-[3-chloro-4-[2-(diethylazaniumyl)ethoxy]-5-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[3-chloro-4-[2-(diethylammonio)ethoxy]-5-methoxy-phenyl]-2-cyano-acrylate Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)[O-])OC

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=C(C=C1Cl)/C=C(/C#N)\C(=O)[O-])OC

InChI

InChI=1S/C17H21ClN2O4/c1-4-20(5-2)6-7-24-16-14(18)9-12(10-15(16)23-3)8-13(11-19)17(21)22/h8-10H,4-7H2,1-3H3,(H,21,22)/b13-8-