3-(7-butyl-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoic acid

Systemtic Name: 3-(7-butyl-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoic acid Openeye Name: 3-(7-butylbenzothiophen-2-yl)-2-(4-isopropylphenyl)-2-methyl-propanoic acid CAS Name: 3-(7-butyl-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoic acid IUPAC Name: 3-(7-butyl-1-benzothiophen-2-yl)-2-methyl-2-(4-propan-2-ylphenyl)propanoic acid Traditional Name: 3-(7-butylbenzothiophen-2-yl)-2-methyl-2-p-cumenyl-propionic acid Formula: C25H30O2S MolecularWeight: 394.5695

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC2=C1SC(=C2)CC(C)(C3=CC=C(C=C3)C(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC=CC2=C1SC(=C2)CC(C)(C3=CC=C(C=C3)C(C)C)C(=O)O

InChI

InChI=1S/C25H30O2S/c1-5-6-8-19-9-7-10-20-15-22(28-23(19)20)16-25(4,24(26)27)21-13-11-18(12-14-21)17(2)3/h7,9-15,17H,5-6,8,16H2,1-4H3,(H,26,27)