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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(5-oxidanylpentoxy)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(5-hydroxypentoxy)-6-isopropoxy-2H-chromene-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(5-hydroxypentoxy)-6-propan-2-yloxy-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(5-hydroxypentoxy)-6-propan-2-yloxy-2H-chromene-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(5-hydroxypentoxy)-6-isopropoxy-2H-chromene-3-carboxylic acid Formula: C25H28O8 MolecularWeight: 456.48502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)OC(C(=C2OCCCCCO)C(=O)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)OC(C(=C2OCCCCCO)C(=O)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H28O8/c1-15(2)32-17-7-9-19-18(13-17)24(29-11-5-3-4-10-26)22(25(27)28)23(33-19)16-6-8-20-21(12-16)31-14-30-20/h6-9,12-13,15,23,26H,3-5,10-11,14H2,1-2H3,(H,27,28)