1,4-bis[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]piperazine

Systemtic Name: 1,4-bis[2-methyl-5-nitro-3-(phenylmethyl)imidazol-4-yl]piperazine Openeye Name: 1,4-bis(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)piperazine CAS Name: 1,4-bis[2-methyl-5-nitro-3-(phenylmethyl)-4-imidazolyl]piperazine IUPAC Name: 1,4-bis(3-benzyl-2-methyl-5-nitroimidazol-4-yl)piperazine Traditional Name: 1,4-bis(3-benzyl-2-methyl-5-nitro-imidazol-4-yl)piperazine Formula: C26H28N8O4 MolecularWeight: 516.55172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=C2)N3CCN(CC3)C4=C(N=C(N4CC5=CC=CC=C5)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=C2)N3CCN(CC3)C4=C(N=C(N4CC5=CC=CC=C5)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H28N8O4/c1-19-27-23(33(35)36)25(31(19)17-21-9-5-3-6-10-21)29-13-15-30(16-14-29)26-24(34(37)38)28-20(2)32(26)18-22-11-7-4-8-12-22/h3-12H,13-18H2,1-2H3