2-morpholin-4-ium-4-ylethyl (E)-2-(4-chloranylphenoxy)-3-phenyl-prop-2-enoate chloride

Systemtic Name: 2-morpholin-4-ium-4-ylethyl (E)-2-(4-chloranylphenoxy)-3-phenyl-prop-2-enoate chloride Openeye Name: 2-morpholin-4-ium-4-ylethyl (E)-2-(4-chlorophenoxy)-3-phenyl-prop-2-enoate chloride CAS Name: (E)-2-(4-chlorophenoxy)-3-phenyl-2-propenoic acid 2-(4-morpholin-4-iumyl)ethyl ester chloride IUPAC Name: 2-morpholin-4-ium-4-ylethyl (E)-2-(4-chlorophenoxy)-3-phenylprop-2-enoate chloride Traditional Name: (E)-2-(4-chlorophenoxy)-3-phenyl-acrylic acid 2-morpholin-4-ium-4-ylethyl ester chloride Formula: C21H23Cl2NO4 MolecularWeight: 424.31762

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC(=O)C(=CC2=CC=CC=C2)OC3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CCOC(=O)/C(=C\C2=CC=CC=C2)/OC3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C21H22ClNO4.ClH/c22-18-6-8-19(9-7-18)27-20(16-17-4-2-1-3-5-17)21(24)26-15-12-23-10-13-25-14-11-23;/h1-9,16H,10-15H2;1H/b20-16+;