(3R,6R)-3-(1H-imidazol-5-ylmethyl)-6-(phenylmethyl)piperazine-2,5-dione

Systemtic Name: (3R,6R)-3-(1H-imidazol-5-ylmethyl)-6-(phenylmethyl)piperazine-2,5-dione Openeye Name: (3R,6R)-3-benzyl-6-(1H-imidazol-5-ylmethyl)piperazine-2,5-dione CAS Name: (3R,6R)-3-(1H-imidazol-5-ylmethyl)-6-(phenylmethyl)piperazine-2,5-dione IUPAC Name: (3R,6R)-3-benzyl-6-(1H-imidazol-5-ylmethyl)piperazine-2,5-dione Traditional Name: (3R,6R)-3-benzyl-6-(1H-imidazol-5-ylmethyl)piperazine-2,5-quinone Formula: C15H16N4O2 MolecularWeight: 284.31314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)NC(C(=O)N2)CC3=CN=CN3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H]2C(=O)N[C@@H](C(=O)N2)CC3=CN=CN3

InChI

InChI=1S/C15H16N4O2/c20-14-12(6-10-4-2-1-3-5-10)18-15(21)13(19-14)7-11-8-16-9-17-11/h1-5,8-9,12-13H,6-7H2,(H,16,17)(H,18,21)(H,19,20)/t12-,13-/m1/s1