1-(2-fluoranyl-5-methyl-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine

Systemtic Name: 1-(2-fluoranyl-5-methyl-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine Openeye Name: 1-(benzenesulfonyl)-4-(2-fluoro-5-methyl-4-nitro-phenyl)piperazine CAS Name: 1-(benzenesulfonyl)-4-(2-fluoro-5-methyl-4-nitrophenyl)piperazine IUPAC Name: 1-(benzenesulfonyl)-4-(2-fluoro-5-methyl-4-nitrophenyl)piperazine Traditional Name: 1-besyl-4-(2-fluoro-5-methyl-4-nitro-phenyl)piperazine Formula: C17H18FN3O4S MolecularWeight: 379.405923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1[N+](=O)[O-])F)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1[N+](=O)[O-])F)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18FN3O4S/c1-13-11-17(15(18)12-16(13)21(22)23)19-7-9-20(10-8-19)26(24,25)14-5-3-2-4-6-14/h2-6,11-12H,7-10H2,1H3