4-(benzimidazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(benzimidazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(benzimidazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(1-benzimidazolyl)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(benzimidazol-1-yl)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(benzimidazol-1-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4S/c1-3-19(4-2)26(24,25)13-9-10-16(17(11-13)21(22)23)20-12-18-14-7-5-6-8-15(14)20/h5-12H,3-4H2,1-2H3