(2S)-2-(dimethylamino)-3-(4-phenylmethoxyphenyl)propanoic acid

Systemtic Name: (2S)-2-(dimethylamino)-3-(4-phenylmethoxyphenyl)propanoic acid Openeye Name: (2S)-3-(4-benzyloxyphenyl)-2-(dimethylamino)propanoic acid CAS Name: (2S)-2-(dimethylamino)-3-(4-phenylmethoxyphenyl)propanoic acid IUPAC Name: (2S)-2-(dimethylamino)-3-(4-phenylmethoxyphenyl)propanoic acid Traditional Name: (2S)-3-(4-benzoxyphenyl)-2-(dimethylamino)propionic acid Formula: C18H21NO3 MolecularWeight: 299.36424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(C)[C@@H](CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H21NO3/c1-19(2)17(18(20)21)12-14-8-10-16(11-9-14)22-13-15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3,(H,20,21)/t17-/m0/s1