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1-[(2S)-butan-2-yl]-2-methyl-5-nitro-benzimidazole

1-[(2S)-butan-2-yl]-2-methyl-5-nitro-benzimidazole

Systemtic Name:1-[(2S)-butan-2-yl]-2-methyl-5-nitro-benzimidazole
Openeye Name:2-methyl-1-[(1S)-1-methylpropyl]-5-nitro-benzimidazole
CAS Name:1-[(2S)-butan-2-yl]-2-methyl-5-nitrobenzimidazole
IUPAC Name:1-[(2S)-butan-2-yl]-2-methyl-5-nitrobenzimidazole
Traditional Name:2-methyl-1-[(1S)-1-methylpropyl]-5-nitro-benzimidazole
Formula: C12H15N3O2
MolecularWeight: 233.2664
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H15N3O2/c1-4-8(2)14-9(3)13-11-7-10(15(16)17)5-6-12(11)14/h5-8H,4H2,1-3H3/t8-/m0/s1


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