(2R)-2-(2-methyl-5-nitro-benzimidazol-1-yl)butan-1-ol

Systemtic Name: (2R)-2-(2-methyl-5-nitro-benzimidazol-1-yl)butan-1-ol Openeye Name: (2R)-2-(2-methyl-5-nitro-benzimidazol-1-yl)butan-1-ol CAS Name: (2R)-2-(2-methyl-5-nitro-1-benzimidazolyl)-1-butanol IUPAC Name: (2R)-2-(2-methyl-5-nitrobenzimidazol-1-yl)butan-1-ol Traditional Name: (2R)-2-(2-methyl-5-nitro-benzimidazol-1-yl)butan-1-ol Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C(=NC2=C1C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CC[C@H](CO)N1C(=NC2=C1C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H15N3O3/c1-3-9(7-16)14-8(2)13-11-6-10(15(17)18)4-5-12(11)14/h4-6,9,16H,3,7H2,1-2H3/t9-/m1/s1