1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazine Formula: C19H19F3N4O8S MolecularWeight: 520.43637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19F3N4O8S/c1-33-16-4-3-13(11-17(16)34-2)35(31,32)24-7-5-23(6-8-24)18-14(25(27)28)9-12(19(20,21)22)10-15(18)26(29)30/h3-4,9-11H,5-8H2,1-2H3