(E)-3-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enoate Openeye Name: (E)-3-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-2-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-2-propenoate IUPAC Name: (E)-3-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]acrylate Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)[O-])OCC[NH+]2CCOCC2

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)[O-])OCC[NH+]2CCOCC2

InChI

InChI=1S/C16H21NO5/c1-20-14-4-2-13(3-5-16(18)19)15(12-14)22-11-8-17-6-9-21-10-7-17/h2-5,12H,6-11H2,1H3,(H,18,19)/b5-3+