3-(1-benzothiophen-2-yl)-2-(4-butylphenyl)-2-methyl-propanoic acid

Systemtic Name: 3-(1-benzothiophen-2-yl)-2-(4-butylphenyl)-2-methyl-propanoic acid Openeye Name: 3-(benzothiophen-2-yl)-2-(4-butylphenyl)-2-methyl-propanoic acid CAS Name: 3-(1-benzothiophen-2-yl)-2-(4-butylphenyl)-2-methylpropanoic acid IUPAC Name: 3-(1-benzothiophen-2-yl)-2-(4-butylphenyl)-2-methylpropanoic acid Traditional Name: 3-(benzothiophen-2-yl)-2-(4-butylphenyl)-2-methyl-propionic acid Formula: C22H24O2S MolecularWeight: 352.48976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C)(CC2=CC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(C)(CC2=CC3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C22H24O2S/c1-3-4-7-16-10-12-18(13-11-16)22(2,21(23)24)15-19-14-17-8-5-6-9-20(17)25-19/h5-6,8-14H,3-4,7,15H2,1-2H3,(H,23,24)