(2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propanoic acid

Systemtic Name: (2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propanoic acid Openeye Name: (2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propanoic acid CAS Name: (2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propanoic acid IUPAC Name: (2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propanoic acid Traditional Name: (2S)-2-(methylamino)-3-[4-(4-phenoxyphenoxy)phenyl]propionic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN[C@@H](CC1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO4/c1-23-21(22(24)25)15-16-7-9-18(10-8-16)27-20-13-11-19(12-14-20)26-17-5-3-2-4-6-17/h2-14,21,23H,15H2,1H3,(H,24,25)/t21-/m0/s1