3-(1H-imidazol-5-ylmethyl)-6-[(4-phenylmethoxyphenyl)methyl]piperazine-2,5-dione

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-6-[(4-phenylmethoxyphenyl)methyl]piperazine-2,5-dione Openeye Name: 3-[(4-benzyloxyphenyl)methyl]-6-(1H-imidazol-5-ylmethyl)piperazine-2,5-dione CAS Name: 3-(1H-imidazol-5-ylmethyl)-6-[(4-phenylmethoxyphenyl)methyl]piperazine-2,5-dione IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-6-[(4-phenylmethoxyphenyl)methyl]piperazine-2,5-dione Traditional Name: 3-(4-benzoxybenzyl)-6-(1H-imidazol-5-ylmethyl)piperazine-2,5-quinone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3C(=O)NC(C(=O)N3)CC4=CN=CN4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3C(=O)NC(C(=O)N3)CC4=CN=CN4

InChI

InChI=1S/C22H22N4O3/c27-21-19(25-22(28)20(26-21)11-17-12-23-14-24-17)10-15-6-8-18(9-7-15)29-13-16-4-2-1-3-5-16/h1-9,12,14,19-20H,10-11,13H2,(H,23,24)(H,25,28)(H,26,27)