3-(1H-imidazol-5-ylmethyl)-1-phenyl-piperazine-2,5-dione

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-1-phenyl-piperazine-2,5-dione Openeye Name: 3-(1H-imidazol-5-ylmethyl)-1-phenyl-piperazine-2,5-dione CAS Name: 3-(1H-imidazol-5-ylmethyl)-1-phenylpiperazine-2,5-dione IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-1-phenylpiperazine-2,5-dione Traditional Name: 3-(1H-imidazol-5-ylmethyl)-1-phenyl-piperazine-2,5-quinone Formula: C14H14N4O2 MolecularWeight: 270.28656

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(C(=O)N1C2=CC=CC=C2)CC3=CN=CN3

Isomeric SMILES

C1C(=O)NC(C(=O)N1C2=CC=CC=C2)CC3=CN=CN3

InChI

InChI=1S/C14H14N4O2/c19-13-8-18(11-4-2-1-3-5-11)14(20)12(17-13)6-10-7-15-9-16-10/h1-5,7,9,12H,6,8H2,(H,15,16)(H,17,19)