1-(3-cyanopropyl)benzimidazole-5-carboxylate

Systemtic Name: 1-(3-cyanopropyl)benzimidazole-5-carboxylate Openeye Name: 1-(3-cyanopropyl)benzimidazole-5-carboxylate CAS Name: 1-(3-cyanopropyl)-5-benzimidazolecarboxylate IUPAC Name: 1-(3-cyanopropyl)benzimidazole-5-carboxylate Traditional Name: 1-(3-cyanopropyl)benzimidazole-5-carboxylate Formula: C12H10N3O2- MolecularWeight: 228.2267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])N=CN2CCCC#N

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])N=CN2CCCC#N

InChI

InChI=1S/C12H11N3O2/c13-5-1-2-6-15-8-14-10-7-9(12(16)17)3-4-11(10)15/h3-4,7-8H,1-2,6H2,(H,16,17)/p-1