4-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(2,4-dichlorobenzoyl)piperazino]-N-methyl-3-nitro-benzenesulfonamide Formula: C18H18Cl2N4O5S MolecularWeight: 473.33032

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18Cl2N4O5S/c1-21-30(28,29)13-3-5-16(17(11-13)24(26)27)22-6-8-23(9-7-22)18(25)14-4-2-12(19)10-15(14)20/h2-5,10-11,21H,6-9H2,1H3