N-[2-[[3,4,5-tris(oxidanyl)phenyl]carbonylamino]phenyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[2-[[3,4,5-tris(oxidanyl)phenyl]carbonylamino]phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-[(3,4,5-trihydroxybenzoyl)amino]phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[2-[[oxo-(3,4,5-trihydroxyphenyl)methyl]amino]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[2-[(3,4,5-trihydroxybenzoyl)amino]phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-(galloylamino)phenyl]-3H-benzimidazole-5-carboxamide Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC3=C(C=C2)N=CN3)NC(=O)C4=CC(=C(C(=C4)O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC3=C(C=C2)N=CN3)NC(=O)C4=CC(=C(C(=C4)O)O)O

InChI

InChI=1S/C21H16N4O5/c26-17-8-12(9-18(27)19(17)28)21(30)25-15-4-2-1-3-14(15)24-20(29)11-5-6-13-16(7-11)23-10-22-13/h1-10,26-28H,(H,22,23)(H,24,29)(H,25,30)