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

Systemtic Name: (E)-3-[3-chloranyl-4-[2-(dimethylazaniumyl)ethoxy]-5-methoxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-methoxyphenyl]-2-propenoate IUPAC Name: (E)-3-[3-chloro-4-[2-(dimethylazaniumyl)ethoxy]-5-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[3-chloro-4-[2-(dimethylammonio)ethoxy]-5-methoxy-phenyl]acrylate Formula: C14H18ClNO4 MolecularWeight: 299.75002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+](C)CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)[O-])OC

InChI

InChI=1S/C14H18ClNO4/c1-16(2)6-7-20-14-11(15)8-10(4-5-13(17)18)9-12(14)19-3/h4-5,8-9H,6-7H2,1-3H3,(H,17,18)/b5-4+