1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperazine

Systemtic Name: 1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperazine Openeye Name: 1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperazine CAS Name: 1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperazine IUPAC Name: 1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]piperazine Traditional Name: 1-(2-methoxyphenyl)-4-(2-nitro-4-triflyl-phenyl)piperazine Formula: C18H18F3N3O5S MolecularWeight: 445.41283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18F3N3O5S/c1-29-17-5-3-2-4-15(17)23-10-8-22(9-11-23)14-7-6-13(12-16(14)24(25)26)30(27,28)18(19,20)21/h2-7,12H,8-11H2,1H3