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

Systemtic Name: (Z)-2-cyano-3-[4-[3-(dimethylazaniumyl)propoxy]phenyl]prop-2-enoate Openeye Name: (Z)-2-cyano-3-[4-[3-(dimethylammonio)propoxy]phenyl]prop-2-enoate CAS Name: (Z)-2-cyano-3-[4-[3-(dimethylammonio)propoxy]phenyl]-2-propenoate IUPAC Name: (Z)-2-cyano-3-[4-[3-(dimethylazaniumyl)propoxy]phenyl]prop-2-enoate Traditional Name: (Z)-2-cyano-3-[4-[3-(dimethylammonio)propoxy]phenyl]acrylate Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCOC1=CC=C(C=C1)/C=C(/C#N)\C(=O)[O-]

InChI

InChI=1S/C15H18N2O3/c1-17(2)8-3-9-20-14-6-4-12(5-7-14)10-13(11-16)15(18)19/h4-7,10H,3,8-9H2,1-2H3,(H,18,19)/b13-10-