1-(4-fluoranyl-2-nitro-phenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(4-fluoranyl-2-nitro-phenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine Openeye Name: 1-(4-fluoro-2-nitro-phenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine CAS Name: 1-(4-fluoro-2-nitrophenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine IUPAC Name: 1-(4-fluoro-2-nitrophenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine Traditional Name: 1-(4-fluoro-2-nitro-phenyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine Formula: C20H24FN3O4S MolecularWeight: 421.485663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)F)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)F)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H24FN3O4S/c1-13-11-14(2)16(4)20(15(13)3)29(27,28)23-9-7-22(8-10-23)18-6-5-17(21)12-19(18)24(25)26/h5-6,11-12H,7-10H2,1-4H3