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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-butoxy-5-propoxy-2H-chromene-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-butoxy-5-propoxy-2H-chromene-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-4-butoxy-5-propoxy-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-butoxy-5-propoxy-2H-chromene-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-butoxy-5-propoxy-2H-chromene-3-carboxylic acid Formula: C24H26O7 MolecularWeight: 426.45904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(OC2=C1C(=CC=C2)OCCC)C3=CC4=C(C=C3)OCO4)C(=O)O

Isomeric SMILES

CCCCOC1=C(C(OC2=C1C(=CC=C2)OCCC)C3=CC4=C(C=C3)OCO4)C(=O)O

InChI

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