(E)-6-(3-chloranyl-2-methoxy-5-methoxycarbonyl-6-oxidanyl-phenyl)-4-methyl-hex-4-enoic acid

Systemtic Name: (E)-6-(3-chloranyl-2-methoxy-5-methoxycarbonyl-6-oxidanyl-phenyl)-4-methyl-hex-4-enoic acid Openeye Name: (E)-6-(5-chloro-2-hydroxy-6-methoxy-3-methoxycarbonyl-phenyl)-4-methyl-hex-4-enoic acid CAS Name: (E)-6-(5-chloro-2-hydroxy-6-methoxy-3-methoxycarbonylphenyl)-4-methyl-4-hexenoic acid IUPAC Name: (E)-6-(5-chloro-2-hydroxy-6-methoxy-3-methoxycarbonylphenyl)-4-methylhex-4-enoic acid Traditional Name: (E)-6-(3-carbomethoxy-5-chloro-2-hydroxy-6-methoxy-phenyl)-4-methyl-hex-4-enoic acid Formula: C16H19ClO6 MolecularWeight: 342.77146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C(=CC(=C1OC)Cl)C(=O)OC)O)CCC(=O)O

Isomeric SMILES

C/C(=C\CC1=C(C(=CC(=C1OC)Cl)C(=O)OC)O)/CCC(=O)O

InChI

InChI=1S/C16H19ClO6/c1-9(5-7-13(18)19)4-6-10-14(20)11(16(21)23-3)8-12(17)15(10)22-2/h4,8,20H,5-7H2,1-3H3,(H,18,19)/b9-4+