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

Systemtic Name: 2-(2-benzamidoethanoylamino)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[(2-benzamidoacetyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[(2-benzamido-1-oxoethyl)amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(2-benzamidoacetyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-(hippuroylamino)-3-(1H-imidazol-5-yl)propionic acid Formula: C15H16N4O4 MolecularWeight: 316.31194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC(=O)NC(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C15H16N4O4/c20-13(8-17-14(21)10-4-2-1-3-5-10)19-12(15(22)23)6-11-7-16-9-18-11/h1-5,7,9,12H,6,8H2,(H,16,18)(H,17,21)(H,19,20)(H,22,23)