1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-propan-2-yloxy-phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-propan-2-yloxy-phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-isopropoxy-phenyl]-5-propoxy-indane-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-propan-2-yloxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-propan-2-yloxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(carboxymethyloxy)-4-isopropoxy-phenyl]-5-propoxy-indane-2-carboxylic acid Formula: C31H32O9 MolecularWeight: 548.58038

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC(C)C)OCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC(C)C)OCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C31H32O9/c1-4-11-36-19-6-8-21-23(13-19)29(22-9-7-20(40-17(2)3)14-25(22)37-15-27(32)33)30(31(34)35)28(21)18-5-10-24-26(12-18)39-16-38-24/h5-10,12-14,17,28-30H,4,11,15-16H2,1-3H3,(H,32,33)(H,34,35)