3-chloranyl-6-(4-ethoxycarbonyl-2-methoxy-3-methyl-5-oxidanyl-phenoxy)-2-methoxy-benzoic acid

Systemtic Name: 3-chloranyl-6-(4-ethoxycarbonyl-2-methoxy-3-methyl-5-oxidanyl-phenoxy)-2-methoxy-benzoic acid Openeye Name: 3-chloro-6-(4-ethoxycarbonyl-5-hydroxy-2-methoxy-3-methyl-phenoxy)-2-methoxy-benzoic acid CAS Name: 3-chloro-6-(4-ethoxycarbonyl-5-hydroxy-2-methoxy-3-methylphenoxy)-2-methoxybenzoic acid IUPAC Name: 3-chloro-6-(4-ethoxycarbonyl-5-hydroxy-2-methoxy-3-methylphenoxy)-2-methoxybenzoic acid Traditional Name: 6-(4-carbethoxy-5-hydroxy-2-methoxy-3-methyl-phenoxy)-3-chloro-2-methoxy-benzoic acid Formula: C19H19ClO8 MolecularWeight: 410.80236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1O)OC2=C(C(=C(C=C2)Cl)OC)C(=O)O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1O)OC2=C(C(=C(C=C2)Cl)OC)C(=O)O)OC)C

InChI

InChI=1S/C19H19ClO8/c1-5-27-19(24)14-9(2)16(25-3)13(8-11(14)21)28-12-7-6-10(20)17(26-4)15(12)18(22)23/h6-8,21H,5H2,1-4H3,(H,22,23)