1-butyl-2-(4-chloranyl-3-nitro-phenyl)benzimidazole-5-carbonitrile

Systemtic Name: 1-butyl-2-(4-chloranyl-3-nitro-phenyl)benzimidazole-5-carbonitrile Openeye Name: 1-butyl-2-(4-chloro-3-nitro-phenyl)benzimidazole-5-carbonitrile CAS Name: 1-butyl-2-(4-chloro-3-nitrophenyl)-5-benzimidazolecarbonitrile IUPAC Name: 1-butyl-2-(4-chloro-3-nitrophenyl)benzimidazole-5-carbonitrile Traditional Name: 1-butyl-2-(4-chloro-3-nitro-phenyl)benzimidazole-5-carbonitrile Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C#N)N=C1C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C#N)N=C1C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O2/c1-2-3-8-22-16-7-4-12(11-20)9-15(16)21-18(22)13-5-6-14(19)17(10-13)23(24)25/h4-7,9-10H,2-3,8H2,1H3