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

Systemtic Name: 1-[(2S)-butan-2-yl]-5-nitro-2-propan-2-yl-benzimidazole Openeye Name: 2-isopropyl-1-[(1S)-1-methylpropyl]-5-nitro-benzimidazole CAS Name: 1-[(2S)-butan-2-yl]-5-nitro-2-propan-2-ylbenzimidazole IUPAC Name: 1-[(2S)-butan-2-yl]-5-nitro-2-propan-2-ylbenzimidazole Traditional Name: 2-isopropyl-1-[(1S)-1-methylpropyl]-5-nitro-benzimidazole Formula: C14H19N3O2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1C(C)C

Isomeric SMILES

CC[C@H](C)N1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1C(C)C

InChI

InChI=1S/C14H19N3O2/c1-5-10(4)16-13-7-6-11(17(18)19)8-12(13)15-14(16)9(2)3/h6-10H,5H2,1-4H3/t10-/m0/s1