(2-methyl-3-nitro-phenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-methyl-3-nitro-phenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-methyl-3-nitro-phenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-methyl-3-nitrophenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-methyl-3-nitrophenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-methyl-3-nitro-phenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]methanone Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-14-13-15(2)17(4)21(16(14)3)31(29,30)24-11-9-23(10-12-24)22(26)19-7-6-8-20(18(19)5)25(27)28/h6-8,13H,9-12H2,1-5H3