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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(4-propan-2-ylphenyl)-2H-chromene-3-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(4-isopropylphenyl)-2H-chromene-3-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(4-propan-2-ylphenyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(4-propan-2-ylphenyl)-2H-chromene-3-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-p-cumenyl-2H-chromene-3-carboxylic acid Formula: C26H22O5 MolecularWeight: 414.44988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(=O)O

InChI

InChI=1S/C26H22O5/c1-15(2)16-7-9-17(10-8-16)23-19-5-3-4-6-20(19)31-25(24(23)26(27)28)18-11-12-21-22(13-18)30-14-29-21/h3-13,15,25H,14H2,1-2H3,(H,27,28)