(Z)-3-[3-chloranyl-5-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-[3-chloranyl-5-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-cyano-prop-2-enoate Openeye Name: (Z)-3-[3-chloro-5-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-cyano-prop-2-enoate CAS Name: (Z)-3-[3-chloro-5-methoxy-4-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-2-cyano-2-propenoate IUPAC Name: (Z)-3-[3-chloro-5-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-cyanoprop-2-enoate Traditional Name: (Z)-3-[3-chloro-5-methoxy-4-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-cyano-acrylate Formula: C17H19ClN2O5 MolecularWeight: 366.79616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O5/c1-23-15-10-12(8-13(11-19)17(21)22)9-14(18)16(15)25-7-4-20-2-5-24-6-3-20/h8-10H,2-7H2,1H3,(H,21,22)/b13-8-