2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-chromene-3-carboxylic acid

Systemtic Name: 2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-chromene-3-carboxylic acid Openeye Name: 2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-chromene-3-carboxylic acid CAS Name: 2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-chromene-3-carboxylic acid Traditional Name: 2,4-bis(1,3-benzodioxol-5-yl)-6-propoxy-2H-chromene-3-carboxylic acid Formula: C27H22O8 MolecularWeight: 474.45878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H22O8/c1-2-9-30-17-5-8-19-18(12-17)24(15-3-6-20-22(10-15)33-13-31-20)25(27(28)29)26(35-19)16-4-7-21-23(11-16)34-14-32-21/h3-8,10-12,26H,2,9,13-14H2,1H3,(H,28,29)