2-phenoxy-2-[(4-pyridin-3-ylphenyl)methylamino]propanoic acid

Systemtic Name: 2-phenoxy-2-[(4-pyridin-3-ylphenyl)methylamino]propanoic acid Openeye Name: 2-phenoxy-2-[[4-(3-pyridyl)phenyl]methylamino]propanoic acid CAS Name: 2-phenoxy-2-[[4-(3-pyridinyl)phenyl]methylamino]propanoic acid IUPAC Name: 2-phenoxy-2-[(4-pyridin-3-ylphenyl)methylamino]propanoic acid Traditional Name: 2-phenoxy-2-[[4-(3-pyridyl)benzyl]amino]propionic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(NCC1=CC=C(C=C1)C2=CN=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)O)(NCC1=CC=C(C=C1)C2=CN=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3/c1-21(20(24)25,26-19-7-3-2-4-8-19)23-14-16-9-11-17(12-10-16)18-6-5-13-22-15-18/h2-13,15,23H,14H2,1H3,(H,24,25)