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

Systemtic Name: 3-[(3-cyanophenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Openeye Name: 3-[(3-cyanophenyl)methyl-(3-pyridylmethyl)amino]propanoic acid CAS Name: 3-[(3-cyanophenyl)methyl-(3-pyridinylmethyl)amino]propanoic acid IUPAC Name: 3-[(3-cyanophenyl)methyl-(pyridin-3-ylmethyl)amino]propanoic acid Traditional Name: 3-[(3-cyanobenzyl)-(3-pyridylmethyl)amino]propionic acid Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN(CCC(=O)O)CC2=CN=CC=C2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN(CCC(=O)O)CC2=CN=CC=C2)C#N

InChI

InChI=1S/C17H17N3O2/c18-10-14-3-1-4-15(9-14)12-20(8-6-17(21)22)13-16-5-2-7-19-11-16/h1-5,7,9,11H,6,8,12-13H2,(H,21,22)