3-bromanyl-5-ethoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-(2-methoxy-2-oxo-ethoxy)benzoic acid CAS Name: 3-bromo-5-ethoxy-4-(2-methoxy-2-oxoethoxy)benzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-(2-methoxy-2-oxoethoxy)benzoic acid Traditional Name: 3-bromo-5-ethoxy-4-(2-keto-2-methoxy-ethoxy)benzoic acid Formula: C12H13BrO6 MolecularWeight: 333.13202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)OC

InChI

InChI=1S/C12H13BrO6/c1-3-18-9-5-7(12(15)16)4-8(13)11(9)19-6-10(14)17-2/h4-5H,3,6H2,1-2H3,(H,15,16)