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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-6-butoxy-4-(4-methoxyphenyl)-2H-chromene-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-6-butoxy-4-(4-methoxyphenyl)-2H-chromene-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-6-butoxy-4-(4-methoxyphenyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-6-butoxy-4-(4-methoxyphenyl)-2H-chromene-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-6-butoxy-4-(4-methoxyphenyl)-2H-chromene-3-carboxylic acid Formula: C28H26O7 MolecularWeight: 474.50184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC=C(C=C3)OC)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)OC(C(=C2C3=CC=C(C=C3)OC)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H26O7/c1-3-4-13-32-20-10-12-22-21(15-20)25(17-5-8-19(31-2)9-6-17)26(28(29)30)27(35-22)18-7-11-23-24(14-18)34-16-33-23/h5-12,14-15,27H,3-4,13,16H2,1-2H3,(H,29,30)