(E)-4-(3-chloranyl-2,5-dimethoxy-phenyl)-3-ethoxycarbonyl-but-3-enoic acid

Systemtic Name: (E)-4-(3-chloranyl-2,5-dimethoxy-phenyl)-3-ethoxycarbonyl-but-3-enoic acid Openeye Name: (E)-4-(3-chloro-2,5-dimethoxy-phenyl)-3-ethoxycarbonyl-but-3-enoic acid CAS Name: (E)-4-(3-chloro-2,5-dimethoxyphenyl)-3-ethoxycarbonyl-3-butenoic acid IUPAC Name: (E)-4-(3-chloro-2,5-dimethoxyphenyl)-3-ethoxycarbonylbut-3-enoic acid Traditional Name: (E)-3-carbethoxy-4-(3-chloro-2,5-dimethoxy-phenyl)but-3-enoic acid Formula: C15H17ClO6 MolecularWeight: 328.74488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=CC(=C1OC)Cl)OC)CC(=O)O

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=CC(=C1OC)Cl)OC)/CC(=O)O

InChI

InChI=1S/C15H17ClO6/c1-4-22-15(19)10(7-13(17)18)5-9-6-11(20-2)8-12(16)14(9)21-3/h5-6,8H,4,7H2,1-3H3,(H,17,18)/b10-5+