1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-4-[(2-nitrophenyl)methyl]piperazine

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-4-[(2-nitrophenyl)methyl]piperazine Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[(2-nitrophenyl)methyl]piperazine CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[(2-nitrophenyl)methyl]piperazine IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-[(2-nitrophenyl)methyl]piperazine Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-(2-nitrobenzyl)piperazine Formula: C18H17ClF3N3O4S MolecularWeight: 463.85849

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H17ClF3N3O4S/c19-16-6-5-14(11-15(16)18(20,21)22)30(28,29)24-9-7-23(8-10-24)12-13-3-1-2-4-17(13)25(26)27/h1-6,11H,7-10,12H2