(2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxy-phenyl]-2-thiophen-2-yl-propanoic acid

Systemtic Name: (2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxy-phenyl]-2-thiophen-2-yl-propanoic acid Openeye Name: (2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxy-phenyl]-2-(2-thienyl)propanoic acid CAS Name: (2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxyphenyl]-2-thiophen-2-ylpropanoic acid IUPAC Name: (2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxyphenyl]-2-thiophen-2-ylpropanoic acid Traditional Name: (2R)-3-[4-[3-(dimethylamino)propoxy]-3-methoxy-phenyl]-2-(2-thienyl)propionic acid Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=C(C=C1)CC(C2=CC=CS2)C(=O)O)OC

Isomeric SMILES

CN(C)CCCOC1=C(C=C(C=C1)C[C@@H](C2=CC=CS2)C(=O)O)OC

InChI

InChI=1S/C19H25NO4S/c1-20(2)9-5-10-24-16-8-7-14(13-17(16)23-3)12-15(19(21)22)18-6-4-11-25-18/h4,6-8,11,13,15H,5,9-10,12H2,1-3H3,(H,21,22)/t15-/m0/s1