4-[2-(hydroxymethyl)-5-nitro-benzimidazol-1-yl]butan-1-ol

Systemtic Name: 4-[2-(hydroxymethyl)-5-nitro-benzimidazol-1-yl]butan-1-ol Openeye Name: 4-[2-(hydroxymethyl)-5-nitro-benzimidazol-1-yl]butan-1-ol CAS Name: 4-[2-(hydroxymethyl)-5-nitro-1-benzimidazolyl]-1-butanol IUPAC Name: 4-[2-(hydroxymethyl)-5-nitrobenzimidazol-1-yl]butan-1-ol Traditional Name: 4-(2-methylol-5-nitro-benzimidazol-1-yl)butan-1-ol Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])N=C(N2CCCCO)CO

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])N=C(N2CCCCO)CO

InChI

InChI=1S/C12H15N3O4/c16-6-2-1-5-14-11-4-3-9(15(18)19)7-10(11)13-12(14)8-17/h3-4,7,16-17H,1-2,5-6,8H2