3-[(3-phenoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid

Systemtic Name: 3-[(3-phenoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Openeye Name: 3-[(3-phenoxyphenyl)methyl-(3-pyridylmethyl)amino]propanoic acid CAS Name: 3-[(3-phenoxyphenyl)methyl-(3-pyridinylmethyl)amino]propanoic acid IUPAC Name: 3-[(3-phenoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Traditional Name: 3-[(3-phenoxybenzyl)-(3-pyridylmethyl)amino]propionic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CCC(=O)O)CC3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CCC(=O)O)CC3=CN=CC=C3

InChI

InChI=1S/C22H22N2O3/c25-22(26)11-13-24(17-19-7-5-12-23-15-19)16-18-6-4-10-21(14-18)27-20-8-2-1-3-9-20/h1-10,12,14-15H,11,13,16-17H2,(H,25,26)