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

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(4-cyclopentyloxyphenyl)-2H-chromene-3-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-[4-(cyclopentoxy)phenyl]-2H-chromene-3-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(4-cyclopentyloxyphenyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-(4-cyclopentyloxyphenyl)-2H-chromene-3-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-butoxy-2-[4-(cyclopentoxy)phenyl]-2H-chromene-3-carboxylic acid Formula: C32H32O7 MolecularWeight: 528.59228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)O)C5=CC=C(C=C5)OC6CCCC6

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC4=C(C=C3)OCO4)C(=O)O)C5=CC=C(C=C5)OC6CCCC6

InChI

InChI=1S/C32H32O7/c1-2-3-16-35-24-13-15-26-25(18-24)29(21-10-14-27-28(17-21)37-19-36-27)30(32(33)34)31(39-26)20-8-11-23(12-9-20)38-22-6-4-5-7-22/h8-15,17-18,22,31H,2-7,16,19H2,1H3,(H,33,34)