(2R)-3-(4-butoxy-3-chloranyl-5-methoxy-phenyl)-2-thiophen-2-yl-propanoic acid

Systemtic Name: (2R)-3-(4-butoxy-3-chloranyl-5-methoxy-phenyl)-2-thiophen-2-yl-propanoic acid Openeye Name: (2R)-3-(4-butoxy-3-chloro-5-methoxy-phenyl)-2-(2-thienyl)propanoic acid CAS Name: (2R)-3-(4-butoxy-3-chloro-5-methoxyphenyl)-2-thiophen-2-ylpropanoic acid IUPAC Name: (2R)-3-(4-butoxy-3-chloro-5-methoxyphenyl)-2-thiophen-2-ylpropanoic acid Traditional Name: (2R)-3-(4-butoxy-3-chloro-5-methoxy-phenyl)-2-(2-thienyl)propionic acid Formula: C18H21ClO4S MolecularWeight: 368.87494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)CC(C2=CC=CS2)C(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C[C@@H](C2=CC=CS2)C(=O)O)OC

InChI

InChI=1S/C18H21ClO4S/c1-3-4-7-23-17-14(19)10-12(11-15(17)22-2)9-13(18(20)21)16-6-5-8-24-16/h5-6,8,10-11,13H,3-4,7,9H2,1-2H3,(H,20,21)/t13-/m0/s1