1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Formula: C19H19F3N4O6S MolecularWeight: 488.43757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19F3N4O6S/c1-12-9-15(25(27)28)11-18(13(12)2)33(31,32)24-7-5-23(6-8-24)16-4-3-14(19(20,21)22)10-17(16)26(29)30/h3-4,9-11H,5-8H2,1-2H3