(Z)-3-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-2-phenyl-prop-2-enoate

Systemtic Name: (Z)-3-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-2-phenyl-prop-2-enoate Openeye Name: (Z)-3-[3-[2-(diethylammonio)ethoxy]phenyl]-2-phenyl-prop-2-enoate CAS Name: (Z)-3-[3-[2-(diethylammonio)ethoxy]phenyl]-2-phenyl-2-propenoate IUPAC Name: (Z)-3-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-2-phenylprop-2-enoate Traditional Name: (Z)-3-[3-[2-(diethylammonio)ethoxy]phenyl]-2-phenyl-acrylate Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=CC(=C1)C=C(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=CC(=C1)/C=C(/C2=CC=CC=C2)\C(=O)[O-]

InChI

InChI=1S/C21H25NO3/c1-3-22(4-2)13-14-25-19-12-8-9-17(15-19)16-20(21(23)24)18-10-6-5-7-11-18/h5-12,15-16H,3-4,13-14H2,1-2H3,(H,23,24)/b20-16-