6-(4-chloranylphenoxy)-4-methyl-4-phenyl-1,3-benzodioxine-2-carboxylic acid

Systemtic Name: 6-(4-chloranylphenoxy)-4-methyl-4-phenyl-1,3-benzodioxine-2-carboxylic acid Openeye Name: 6-(4-chlorophenoxy)-4-methyl-4-phenyl-1,3-benzodioxine-2-carboxylic acid CAS Name: 6-(4-chlorophenoxy)-4-methyl-4-phenyl-1,3-benzodioxin-2-carboxylic acid IUPAC Name: 6-(4-chlorophenoxy)-4-methyl-4-phenyl-1,3-benzodioxine-2-carboxylic acid Traditional Name: 6-(4-chlorophenoxy)-4-methyl-4-phenyl-1,3-benzodioxin-2-carboxylic acid Formula: C22H17ClO5 MolecularWeight: 396.82038

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)OC3=CC=C(C=C3)Cl)OC(O1)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1(C2=C(C=CC(=C2)OC3=CC=C(C=C3)Cl)OC(O1)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H17ClO5/c1-22(14-5-3-2-4-6-14)18-13-17(26-16-9-7-15(23)8-10-16)11-12-19(18)27-21(28-22)20(24)25/h2-13,21H,1H3,(H,24,25)