2-(1,3-dihydroisoindol-2-yl)-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-(1,3-dihydroisoindol-2-yl)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-isoindolin-2-yl-propanoic acid CAS Name: 2-(1,3-dihydroisoindol-2-yl)-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-(1,3-dihydroisoindol-2-yl)-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-isoindolin-2-yl-propionic acid Formula: C14H15N3O2 MolecularWeight: 257.2878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C(CC3=CN=CN3)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2CN1C(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C14H15N3O2/c18-14(19)13(5-12-6-15-9-16-12)17-7-10-3-1-2-4-11(10)8-17/h1-4,6,9,13H,5,7-8H2,(H,15,16)(H,18,19)