(2R)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-thiophen-2-yl-propanoate

Systemtic Name: (2R)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-thiophen-2-yl-propanoate Openeye Name: (2R)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-(2-thienyl)propanoate CAS Name: (2R)-3-[4-(2-tert-butyl-5-methylphenoxy)phenyl]-2-thiophen-2-ylpropanoate IUPAC Name: (2R)-3-[4-(2-tert-butyl-5-methylphenoxy)phenyl]-2-thiophen-2-ylpropanoate Traditional Name: (2R)-3-[4-(2-tert-butyl-5-methyl-phenoxy)phenyl]-2-(2-thienyl)propionate Formula: C24H25O3S- MolecularWeight: 393.5185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OC2=CC=C(C=C2)CC(C3=CC=CS3)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OC2=CC=C(C=C2)C[C@@H](C3=CC=CS3)C(=O)[O-]

InChI

InChI=1S/C24H26O3S/c1-16-7-12-20(24(2,3)4)21(14-16)27-18-10-8-17(9-11-18)15-19(23(25)26)22-6-5-13-28-22/h5-14,19H,15H2,1-4H3,(H,25,26)/p-1/t19-/m0/s1