3-(1,3-benzodioxol-5-yl)-3-(2-heptoxy-4-methoxy-phenyl)-6-propoxy-1,2-dihydroindene-2-carboxylic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-3-(2-heptoxy-4-methoxy-phenyl)-6-propoxy-1,2-dihydroindene-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-1-(2-heptoxy-4-methoxy-phenyl)-5-propoxy-indane-2-carboxylic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-3-(2-heptoxy-4-methoxyphenyl)-6-propoxy-1,2-dihydroindene-2-carboxylic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-(2-heptoxy-4-methoxyphenyl)-6-propoxy-1,2-dihydroindene-2-carboxylic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-1-(2-heptoxy-4-methoxy-phenyl)-5-propoxy-indane-2-carboxylic acid Formula: C34H40O7 MolecularWeight: 560.6772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=CC(=C1)OC)C2(C(CC3=C2C=CC(=C3)OCCC)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCCCCOC1=C(C=CC(=C1)OC)C2(C(CC3=C2C=CC(=C3)OCCC)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C34H40O7/c1-4-6-7-8-9-17-39-31-21-25(37-3)11-14-28(31)34(24-10-15-30-32(20-24)41-22-40-30)27-13-12-26(38-16-5-2)18-23(27)19-29(34)33(35)36/h10-15,18,20-21,29H,4-9,16-17,19,22H2,1-3H3,(H,35,36)