3-(1H-imidazol-5-yl)-2-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-(3-oxidanylidene-1H-isoindol-2-yl)propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-(1-oxoisoindolin-2-yl)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-(3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-(3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-(1-ketoisoindolin-2-yl)propionic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C(CC3=CN=CN3)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1C(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C14H13N3O3/c18-13-11-4-2-1-3-9(11)7-17(13)12(14(19)20)5-10-6-15-8-16-10/h1-4,6,8,12H,5,7H2,(H,15,16)(H,19,20)