3-methoxy-2-oxidanyl-6-(8-phenylmethoxybenzo[f][1,3]benzodioxol-6-yl)benzoic acid

Systemtic Name: 3-methoxy-2-oxidanyl-6-(8-phenylmethoxybenzo[f][1,3]benzodioxol-6-yl)benzoic acid Openeye Name: 6-(8-benzyloxybenzo[f][1,3]benzodioxol-6-yl)-2-hydroxy-3-methoxy-benzoic acid CAS Name: 2-hydroxy-3-methoxy-6-(8-phenylmethoxy-6-benzo[f][1,3]benzodioxolyl)benzoic acid IUPAC Name: 2-hydroxy-3-methoxy-6-(8-phenylmethoxybenzo[f][1,3]benzodioxol-6-yl)benzoic acid Traditional Name: 6-(8-benzoxybenzo[f][1,3]benzodioxol-6-yl)-2-hydroxy-3-methoxy-benzoic acid Formula: C26H20O7 MolecularWeight: 444.4328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CC(=C3C=C4C(=CC3=C2)OCO4)OCC5=CC=CC=C5)C(=O)O)O

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CC(=C3C=C4C(=CC3=C2)OCO4)OCC5=CC=CC=C5)C(=O)O)O

InChI

InChI=1S/C26H20O7/c1-30-20-8-7-18(24(25(20)27)26(28)29)16-9-17-11-22-23(33-14-32-22)12-19(17)21(10-16)31-13-15-5-3-2-4-6-15/h2-12,27H,13-14H2,1H3,(H,28,29)