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

Systemtic Name: (Z)-3-[5-chloranyl-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-phenyl-prop-2-enoate Openeye Name: (Z)-3-[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-phenyl-prop-2-enoate CAS Name: (Z)-3-[5-chloro-2-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-2-phenyl-2-propenoate IUPAC Name: (Z)-3-[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-phenylprop-2-enoate Traditional Name: (Z)-3-[5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-2-phenyl-acrylate Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=C(C=C(C=C2)Cl)C=C(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCOC2=C(C=C(C=C2)Cl)/C=C(/C3=CC=CC=C3)\C(=O)[O-]

InChI

InChI=1S/C21H22ClNO4/c22-18-6-7-20(27-13-10-23-8-11-26-12-9-23)17(14-18)15-19(21(24)25)16-4-2-1-3-5-16/h1-7,14-15H,8-13H2,(H,24,25)/b19-15-