methyl 2-[2-ethyl-6-(3-methoxyphenyl)carbonyl-3,5-bis(oxidanyl)phenyl]ethanoate

Systemtic Name: methyl 2-[2-ethyl-6-(3-methoxyphenyl)carbonyl-3,5-bis(oxidanyl)phenyl]ethanoate Openeye Name: methyl 2-[2-ethyl-3,5-dihydroxy-6-(3-methoxybenzoyl)phenyl]acetate CAS Name: 2-[2-ethyl-3,5-dihydroxy-6-[(3-methoxyphenyl)-oxomethyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-ethyl-3,5-dihydroxy-6-(3-methoxybenzoyl)phenyl]acetate Traditional Name: 2-(2-ethyl-3,5-dihydroxy-6-m-anisoyl-phenyl)acetic acid methyl ester Formula: C19H20O6 MolecularWeight: 344.3585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1CC(=O)OC)C(=O)C2=CC(=CC=C2)OC)O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1CC(=O)OC)C(=O)C2=CC(=CC=C2)OC)O)O

InChI

InChI=1S/C19H20O6/c1-4-13-14(9-17(22)25-3)18(16(21)10-15(13)20)19(23)11-6-5-7-12(8-11)24-2/h5-8,10,20-21H,4,9H2,1-3H3