2-[3,5-bis(methoxymethoxy)-2-(4-methoxyphenyl)carbonyl-phenyl]-2-bromanyl-ethanoic acid

Systemtic Name: 2-[3,5-bis(methoxymethoxy)-2-(4-methoxyphenyl)carbonyl-phenyl]-2-bromanyl-ethanoic acid Openeye Name: 2-bromo-2-[2-(4-methoxybenzoyl)-3,5-bis(methoxymethoxy)phenyl]acetic acid CAS Name: 2-[3,5-bis(methoxymethoxy)-2-[(4-methoxyphenyl)-oxomethyl]phenyl]-2-bromoacetic acid IUPAC Name: 2-bromo-2-[2-(4-methoxybenzoyl)-3,5-bis(methoxymethoxy)phenyl]acetic acid Traditional Name: 2-[3,5-bis(methoxymethoxy)-2-p-anisoyl-phenyl]-2-bromo-acetic acid Formula: C20H21BrO8 MolecularWeight: 469.27994

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=CC(=C(C(=C1)C(C(=O)O)Br)C(=O)C2=CC=C(C=C2)OC)OCOC

Isomeric SMILES

COCOC1=CC(=C(C(=C1)C(C(=O)O)Br)C(=O)C2=CC=C(C=C2)OC)OCOC

InChI

InChI=1S/C20H21BrO8/c1-25-10-28-14-8-15(18(21)20(23)24)17(16(9-14)29-11-26-2)19(22)12-4-6-13(27-3)7-5-12/h4-9,18H,10-11H2,1-3H3,(H,23,24)