N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-nitro-benzenesulfonamide Formula: C15H14N4O4S MolecularWeight: 346.36106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O4S/c20-19(21)11-5-7-12(8-6-11)24(22,23)16-10-9-15-17-13-3-1-2-4-14(13)18-15/h1-8,16H,9-10H2,(H,17,18)