(2R)-3-(2-chloranyl-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: (2R)-3-(2-chloranyl-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: (2R)-3-(2-chloro-5-nitro-phenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxo-propanenitrile CAS Name: (2R)-3-(2-chloro-5-nitrophenyl)-2-(1-methyl-2-benzimidazolyl)-3-oxopropanenitrile IUPAC Name: (2R)-3-(2-chloro-5-nitrophenyl)-2-(1-methylbenzimidazol-2-yl)-3-oxopropanenitrile Traditional Name: (2R)-3-(2-chloro-5-nitro-phenyl)-3-keto-2-(1-methylbenzimidazol-2-yl)propionitrile Formula: C17H11ClN4O3 MolecularWeight: 354.74724

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@@H](C#N)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClN4O3/c1-21-15-5-3-2-4-14(15)20-17(21)12(9-19)16(23)11-8-10(22(24)25)6-7-13(11)18/h2-8,12H,1H3/t12-/m0/s1