2-[[3-(1,3-benzodioxol-5-yl)-2-carboxy-3-(4-methoxyphenyl)-6-propoxy-1H-inden-2-yl]oxy]pyridine-3-carboxylic acid

Systemtic Name: 2-[[3-(1,3-benzodioxol-5-yl)-2-carboxy-3-(4-methoxyphenyl)-6-propoxy-1H-inden-2-yl]oxy]pyridine-3-carboxylic acid Openeye Name: 2-[1-(1,3-benzodioxol-5-yl)-2-carboxy-1-(4-methoxyphenyl)-5-propoxy-indan-2-yl]oxypyridine-3-carboxylic acid CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-2-carboxy-3-(4-methoxyphenyl)-6-propoxy-1H-inden-2-yl]oxy]-3-pyridinecarboxylic acid IUPAC Name: 2-[[3-(1,3-benzodioxol-5-yl)-2-carboxy-3-(4-methoxyphenyl)-6-propoxy-1H-inden-2-yl]oxy]pyridine-3-carboxylic acid Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)-2-carboxy-1-(4-methoxyphenyl)-5-propoxy-indan-2-yl]oxynicotinic acid Formula: C33H29NO9 MolecularWeight: 583.58466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2)(C(=O)O)OC3=C(C=CC=N3)C(=O)O)(C4=CC=C(C=C4)OC)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2)(C(=O)O)OC3=C(C=CC=N3)C(=O)O)(C4=CC=C(C=C4)OC)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C33H29NO9/c1-3-15-40-24-11-12-26-20(16-24)18-32(31(37)38,43-29-25(30(35)36)5-4-14-34-29)33(26,21-6-9-23(39-2)10-7-21)22-8-13-27-28(17-22)42-19-41-27/h4-14,16-17H,3,15,18-19H2,1-2H3,(H,35,36)(H,37,38)