N-(2-chloroethyl)-6-fluoranyl-5-nitro-2-oxidanylidene-3-propan-2-yl-benzimidazole-1-carboxamide

Systemtic Name: N-(2-chloroethyl)-6-fluoranyl-5-nitro-2-oxidanylidene-3-propan-2-yl-benzimidazole-1-carboxamide Openeye Name: N-(2-chloroethyl)-6-fluoro-3-isopropyl-5-nitro-2-oxo-benzimidazole-1-carboxamide CAS Name: N-(2-chloroethyl)-6-fluoro-5-nitro-2-oxo-3-propan-2-yl-1-benzimidazolecarboxamide IUPAC Name: N-(2-chloroethyl)-6-fluoro-5-nitro-2-oxo-3-propan-2-ylbenzimidazole-1-carboxamide Traditional Name: N-(2-chloroethyl)-6-fluoro-3-isopropyl-2-keto-5-nitro-benzimidazole-1-carboxamide Formula: C13H14ClFN4O4 MolecularWeight: 344.726063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC(=C(C=C2N(C1=O)C(=O)NCCCl)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C2=CC(=C(C=C2N(C1=O)C(=O)NCCCl)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14ClFN4O4/c1-7(2)17-11-6-9(19(22)23)8(15)5-10(11)18(13(17)21)12(20)16-4-3-14/h5-7H,3-4H2,1-2H3,(H,16,20)