5-nitro-1-(phenylmethyl)-2-piperazin-1-yl-benzimidazole

Systemtic Name: 5-nitro-1-(phenylmethyl)-2-piperazin-1-yl-benzimidazole Openeye Name: 1-benzyl-5-nitro-2-piperazin-1-yl-benzimidazole CAS Name: 5-nitro-1-(phenylmethyl)-2-(1-piperazinyl)benzimidazole IUPAC Name: 1-benzyl-5-nitro-2-piperazin-1-ylbenzimidazole Traditional Name: 1-benzyl-5-nitro-2-piperazino-benzimidazole Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2/c24-23(25)15-6-7-17-16(12-15)20-18(21-10-8-19-9-11-21)22(17)13-14-4-2-1-3-5-14/h1-7,12,19H,8-11,13H2