1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-methylsulfonyl-2-nitrophenyl)piperazine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-methylsulfonyl-2-nitrophenyl)piperazine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(4-mesyl-2-nitro-phenyl)piperazine Formula: C19H21N3O8S2 MolecularWeight: 483.51534

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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=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O8S2/c1-31(25,26)14-2-4-16(17(12-14)22(23)24)20-6-8-21(9-7-20)32(27,28)15-3-5-18-19(13-15)30-11-10-29-18/h2-5,12-13H,6-11H2,1H3