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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1O)OC2=C(C=CC(=C2C(=O)O)OC)Cl)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1O)OC2=C(C=CC(=C2C(=O)O)OC)Cl)OC)C

InChI

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