2-[4-[4-(2-butan-2-yl-1-benzothiophen-3-yl)phenyl]phenoxy]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[4-(2-butan-2-yl-1-benzothiophen-3-yl)phenyl]phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-phenyl-2-[4-[4-(2-sec-butylbenzothiophen-3-yl)phenyl]phenoxy]acetic acid CAS Name: 2-[4-[4-(2-butan-2-yl-1-benzothiophen-3-yl)phenyl]phenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[4-(2-butan-2-yl-1-benzothiophen-3-yl)phenyl]phenoxy]-2-phenylacetic acid Traditional Name: 2-phenyl-2-[4-[4-(2-sec-butylbenzothiophen-3-yl)phenyl]phenoxy]acetic acid Formula: C32H28O3S MolecularWeight: 492.62792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=C(C=C4)OC(C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CCC(C)C1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=C(C=C4)OC(C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C32H28O3S/c1-3-21(2)31-29(27-11-7-8-12-28(27)36-31)24-15-13-22(14-16-24)23-17-19-26(20-18-23)35-30(32(33)34)25-9-5-4-6-10-25/h4-21,30H,3H2,1-2H3,(H,33,34)