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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3-carboxyphenyl)-4-methoxy-phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3-carboxyphenyl)-4-methoxy-phenyl]-5-propoxy-indane-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3-carboxyphenyl)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3-carboxyphenyl)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(3-carboxyphenyl)-4-methoxy-phenyl]-5-propoxy-indane-2-carboxylic acid Formula: C34H30O8 MolecularWeight: 566.5972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)C4=CC(=CC=C4)C(=O)O)C(=O)O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)C4=CC(=CC=C4)C(=O)O)C(=O)O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C34H30O8/c1-3-13-40-23-9-11-25-27(17-23)31(32(34(37)38)30(25)20-7-12-28-29(15-20)42-18-41-28)24-10-8-22(39-2)16-26(24)19-5-4-6-21(14-19)33(35)36/h4-12,14-17,30-32H,3,13,18H2,1-2H3,(H,35,36)(H,37,38)