3-(4-chloranyl-5,6-dimethoxy-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenoxy)propanoic acid

Systemtic Name: 3-(4-chloranyl-5,6-dimethoxy-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenoxy)propanoic acid Openeye Name: 3-(4-chloro-5,6-dimethoxy-benzothiophen-2-yl)-2-(4-isopropylphenoxy)-2-methyl-propanoic acid CAS Name: 3-(4-chloro-5,6-dimethoxy-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenoxy)propanoic acid IUPAC Name: 3-(4-chloro-5,6-dimethoxy-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenoxy)propanoic acid Traditional Name: 3-(4-chloro-5,6-dimethoxy-benzothiophen-2-yl)-2-(4-isopropylphenoxy)-2-methyl-propionic acid Formula: C23H25ClO5S MolecularWeight: 448.9596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC(C)(CC2=CC3=C(S2)C=C(C(=C3Cl)OC)OC)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC(C)(CC2=CC3=C(S2)C=C(C(=C3Cl)OC)OC)C(=O)O

InChI

InChI=1S/C23H25ClO5S/c1-13(2)14-6-8-15(9-7-14)29-23(3,22(25)26)12-16-10-17-19(30-16)11-18(27-4)21(28-5)20(17)24/h6-11,13H,12H2,1-5H3,(H,25,26)