2-(1,3-benzodioxol-5-yl)-4-(4-oxidanylbutyl)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(4-oxidanylbutyl)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(4-hydroxybutyl)-6-isopropoxy-2H-chromene-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(4-hydroxybutyl)-6-propan-2-yloxy-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(4-hydroxybutyl)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(4-hydroxybutyl)-6-isopropoxy-2H-chromene-3-carboxylic acid Formula: C24H26O7 MolecularWeight: 426.45904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)OC(C(=C2CCCCO)C(=O)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)OC(C(=C2CCCCO)C(=O)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H26O7/c1-14(2)30-16-7-9-19-18(12-16)17(5-3-4-10-25)22(24(26)27)23(31-19)15-6-8-20-21(11-15)29-13-28-20/h6-9,11-12,14,23,25H,3-5,10,13H2,1-2H3,(H,26,27)