2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxy-phenyl]cyclopentane-1-carboxylic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxy-phenyl]cyclopentane-1-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxy-phenyl]cyclopentanecarboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxyphenyl]-1-cyclopentanecarboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxyphenyl]cyclopentane-1-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-[2-(carboxymethyloxy)-4-methoxy-phenyl]cyclopentanecarboxylic acid Formula: C22H22O8 MolecularWeight: 414.40528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC(C2C(=O)O)C3=CC4=C(C=C3)OCO4)OCC(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCC(C2C(=O)O)C3=CC4=C(C=C3)OCO4)OCC(=O)O

InChI

InChI=1S/C22H22O8/c1-27-13-3-4-15(18(9-13)28-10-20(23)24)16-6-5-14(21(16)22(25)26)12-2-7-17-19(8-12)30-11-29-17/h2-4,7-9,14,16,21H,5-6,10-11H2,1H3,(H,23,24)(H,25,26)