N,N-dimethyl-4-(4-methyl-2-phenyl-piperazin-1-yl)sulfonyl-3-nitro-benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-(4-methyl-2-phenyl-piperazin-1-yl)sulfonyl-3-nitro-benzenesulfonamide Openeye Name: N,N-dimethyl-4-(4-methyl-2-phenyl-piperazin-1-yl)sulfonyl-3-nitro-benzenesulfonamide CAS Name: N,N-dimethyl-4-[(4-methyl-2-phenyl-1-piperazinyl)sulfonyl]-3-nitrobenzenesulfonamide IUPAC Name: N,N-dimethyl-4-(4-methyl-2-phenylpiperazin-1-yl)sulfonyl-3-nitrobenzenesulfonamide Traditional Name: N,N-dimethyl-4-(4-methyl-2-phenyl-piperazino)sulfonyl-3-nitro-benzenesulfonamide Formula: C19H24N4O6S2 MolecularWeight: 468.54706

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O6S2/c1-20(2)30(26,27)16-9-10-19(17(13-16)23(24)25)31(28,29)22-12-11-21(3)14-18(22)15-7-5-4-6-8-15/h4-10,13,18H,11-12,14H2,1-3H3