6-bromanyl-4-(6-bromanyl-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 6-bromanyl-4-(6-bromanyl-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-1,3-benzodioxole-5-carboxylic acid Openeye Name: 6-bromo-4-(6-bromo-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-1,3-benzodioxole-5-carboxylic acid CAS Name: 6-bromo-4-(6-bromo-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 6-bromo-4-(6-bromo-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-1,3-benzodioxole-5-carboxylic acid Traditional Name: 6-bromo-4-(6-bromo-5-carboxy-7-methoxy-1,3-benzodioxol-4-yl)-7-methoxy-piperonylic acid Formula: C18H12Br2O10 MolecularWeight: 548.08988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1OCO2)C3=C(C(=C(C4=C3OCO4)OC)Br)C(=O)O)C(=O)O)Br

Isomeric SMILES

COC1=C(C(=C(C2=C1OCO2)C3=C(C(=C(C4=C3OCO4)OC)Br)C(=O)O)C(=O)O)Br

InChI

InChI=1S/C18H12Br2O10/c1-25-13-9(19)7(17(21)22)5(11-15(13)29-3-27-11)6-8(18(23)24)10(20)14(26-2)16-12(6)28-4-30-16/h3-4H2,1-2H3,(H,21,22)(H,23,24)