1-[4-[(4-bromophenyl)sulfonylmethyl]-2-methyl-5-nitro-imidazol-1-yl]propan-2-ol

Systemtic Name: 1-[4-[(4-bromophenyl)sulfonylmethyl]-2-methyl-5-nitro-imidazol-1-yl]propan-2-ol Openeye Name: 1-[4-[(4-bromophenyl)sulfonylmethyl]-2-methyl-5-nitro-imidazol-1-yl]propan-2-ol CAS Name: 1-[4-[(4-bromophenyl)sulfonylmethyl]-2-methyl-5-nitro-1-imidazolyl]-2-propanol IUPAC Name: 1-[4-[(4-bromophenyl)sulfonylmethyl]-2-methyl-5-nitroimidazol-1-yl]propan-2-ol Traditional Name: 1-[4-(brosylmethyl)-2-methyl-5-nitro-imidazol-1-yl]propan-2-ol Formula: C14H16BrN3O5S MolecularWeight: 418.26294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC(C)O)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NC(=C(N1CC(C)O)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3O5S/c1-9(19)7-17-10(2)16-13(14(17)18(20)21)8-24(22,23)12-5-3-11(15)4-6-12/h3-6,9,19H,7-8H2,1-2H3