N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide Openeye Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitro-benzenesulfonamide CAS Name: N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-(2-methylimidazol-1-yl)benzyl]-3-nitro-benzenesulfonamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4S/c1-13-18-9-10-20(13)15-7-5-14(6-8-15)12-19-26(24,25)17-4-2-3-16(11-17)21(22)23/h2-11,19H,12H2,1H3