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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(carboxymethyloxy)-4-methoxy-phenyl]-4-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(carboxymethyloxy)-4-methoxy-phenyl]-4-propoxy-indane-2-carboxylic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(carboxymethyloxy)-4-methoxyphenyl]-4-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(carboxymethyloxy)-4-methoxyphenyl]-4-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(carboxymethyloxy)-4-methoxy-phenyl]-4-propoxy-indane-2-carboxylic acid Formula: C29H28O9 MolecularWeight: 520.52722

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC2=C1C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC=CC2=C1C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H28O9/c1-3-11-35-21-6-4-5-19-26(18-9-8-17(34-2)13-22(18)36-14-24(30)31)28(29(32)33)25(27(19)21)16-7-10-20-23(12-16)38-15-37-20/h4-10,12-13,25-26,28H,3,11,14-15H2,1-2H3,(H,30,31)(H,32,33)