(2-methyl-3-nitro-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-methyl-3-nitro-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-methyl-3-nitro-phenyl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: (2-methyl-3-nitrophenyl)-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-methyl-3-nitrophenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (2-methyl-3-nitro-phenyl)-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C22H21N3O5S MolecularWeight: 439.48424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H21N3O5S/c1-16-20(7-4-8-21(16)25(27)28)22(26)23-11-13-24(14-12-23)31(29,30)19-10-9-17-5-2-3-6-18(17)15-19/h2-10,15H,11-14H2,1H3