methyl (2R)-2-[4-[4-(2-butyl-1-benzothiophen-3-yl)phenyl]phenoxy]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[4-[4-(2-butyl-1-benzothiophen-3-yl)phenyl]phenoxy]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[4-[4-(2-butylbenzothiophen-3-yl)phenyl]phenoxy]-3-phenyl-propanoate CAS Name: (2R)-2-[4-[4-(2-butyl-1-benzothiophen-3-yl)phenyl]phenoxy]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[4-[4-(2-butyl-1-benzothiophen-3-yl)phenyl]phenoxy]-3-phenylpropanoate Traditional Name: (2R)-2-[4-[4-(2-butylbenzothiophen-3-yl)phenyl]phenoxy]-3-phenyl-propionic acid methyl ester Formula: C34H32O3S MolecularWeight: 520.68108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2S1)C3=CC=C(C=C3)C4=CC=C(C=C4)O[C@H](CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C34H32O3S/c1-3-4-13-32-33(29-12-8-9-14-31(29)38-32)27-17-15-25(16-18-27)26-19-21-28(22-20-26)37-30(34(35)36-2)23-24-10-6-5-7-11-24/h5-12,14-22,30H,3-4,13,23H2,1-2H3/t30-/m1/s1