N-[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]-3-pyridin-3-yl-propanamide

Systemtic Name: N-[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]-3-pyridin-3-yl-propanamide Openeye Name: N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]-3-(3-pyridyl)propanamide CAS Name: N-[4-(1-hydroxy-6-nitro-2-benzimidazolyl)phenyl]-3-(3-pyridinyl)propanamide IUPAC Name: N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]-3-pyridin-3-ylpropanamide Traditional Name: N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]-3-(3-pyridyl)propionamide Formula: C21H17N5O4 MolecularWeight: 403.39078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CCC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O4/c27-20(10-3-14-2-1-11-22-13-14)23-16-6-4-15(5-7-16)21-24-18-9-8-17(26(29)30)12-19(18)25(21)28/h1-2,4-9,11-13,28H,3,10H2,(H,23,27)