1-(4-methylsulfonyl-2-nitro-phenyl)-4-naphthalen-2-ylsulfonyl-piperazine

Systemtic Name: 1-(4-methylsulfonyl-2-nitro-phenyl)-4-naphthalen-2-ylsulfonyl-piperazine Openeye Name: 1-(4-methylsulfonyl-2-nitro-phenyl)-4-(2-naphthylsulfonyl)piperazine CAS Name: 1-(4-methylsulfonyl-2-nitrophenyl)-4-(2-naphthalenylsulfonyl)piperazine IUPAC Name: 1-(4-methylsulfonyl-2-nitrophenyl)-4-naphthalen-2-ylsulfonylpiperazine Traditional Name: 1-(4-mesyl-2-nitro-phenyl)-4-(2-naphthylsulfonyl)piperazine Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O6S2/c1-31(27,28)18-8-9-20(21(15-18)24(25)26)22-10-12-23(13-11-22)32(29,30)19-7-6-16-4-2-3-5-17(16)14-19/h2-9,14-15H,10-13H2,1H3