N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide

Systemtic Name: N-[3-[4-(oxidanylcarbamoyl)phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide Openeye Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide CAS Name: N-[3-[4-[(hydroxyamino)-oxomethyl]phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide IUPAC Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide Traditional Name: N-[3-[4-(hydroxycarbamoyl)phenyl]prop-2-ynyl]-1H-benzimidazole-2-carboxamide Formula: C18H14N4O3 MolecularWeight: 334.32876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C(=O)NCC#CC3=CC=C(C=C3)C(=O)NO

InChI

InChI=1S/C18H14N4O3/c23-17(22-25)13-9-7-12(8-10-13)4-3-11-19-18(24)16-20-14-5-1-2-6-15(14)21-16/h1-2,5-10,25H,11H2,(H,19,24)(H,20,21)(H,22,23)