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

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(2-methyl-3-nitro-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(2-methyl-3-nitrophenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(2-methyl-3-nitrophenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(2-methyl-3-nitro-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C18H18F3N3O4S MolecularWeight: 429.41343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18F3N3O4S/c1-13-16(24(25)26)6-3-7-17(13)29(27,28)23-10-8-22(9-11-23)15-5-2-4-14(12-15)18(19,20)21/h2-7,12H,8-11H2,1H3