N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-1-(3-nitrophenyl)methanesulfonamide

Systemtic Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-1-(3-nitrophenyl)methanesulfonamide Openeye Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-1-(3-nitrophenyl)methanesulfonamide CAS Name: N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]-1-(3-nitrophenyl)methanesulfonamide IUPAC Name: N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-1-(3-nitrophenyl)methanesulfonamide Traditional Name: N-[4-(2-methylimidazol-1-yl)benzyl]-1-(3-nitrophenyl)methanesulfonamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-14-19-9-10-21(14)17-7-5-15(6-8-17)12-20-27(25,26)13-16-3-2-4-18(11-16)22(23)24/h2-11,20H,12-13H2,1H3