2-[3-[2-[(4-methoxyphenyl)methyl]-1-benzothiophen-3-yl]-4-phenyl-phenoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-[3-[2-[(4-methoxyphenyl)methyl]-1-benzothiophen-3-yl]-4-phenyl-phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[3-[2-[(4-methoxyphenyl)methyl]benzothiophen-3-yl]-4-phenyl-phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[3-[2-[(4-methoxyphenyl)methyl]-1-benzothiophen-3-yl]-4-phenylphenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[3-[2-[(4-methoxyphenyl)methyl]-1-benzothiophen-3-yl]-4-phenylphenoxy]-3-phenylpropanoic acid Traditional Name: 2-[3-(2-p-anisylbenzothiophen-3-yl)-4-phenyl-phenoxy]-3-phenyl-propionic acid Formula: C37H30O4S MolecularWeight: 570.6967

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(C3=CC=CC=C3S2)C4=C(C=CC(=C4)OC(CC5=CC=CC=C5)C(=O)O)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(C3=CC=CC=C3S2)C4=C(C=CC(=C4)OC(CC5=CC=CC=C5)C(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C37H30O4S/c1-40-28-18-16-26(17-19-28)23-35-36(31-14-8-9-15-34(31)42-35)32-24-29(20-21-30(32)27-12-6-3-7-13-27)41-33(37(38)39)22-25-10-4-2-5-11-25/h2-21,24,33H,22-23H2,1H3,(H,38,39)