N-[(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitro-ethenyl]-4-(trifluoromethyloxy)aniline

Systemtic Name: N-[(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitro-ethenyl]-4-(trifluoromethyloxy)aniline Openeye Name: N-[(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitro-vinyl]-4-(trifluoromethoxy)aniline CAS Name: N-[(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-4-(trifluoromethoxy)aniline IUPAC Name: N-[(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-4-(trifluoromethoxy)aniline Traditional Name: [(E)-2-(4-tert-butylphenyl)sulfonyl-2-nitro-vinyl]-[4-(trifluoromethoxy)phenyl]amine Formula: C19H19F3N2O5S MolecularWeight: 444.42477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)/C(=C/NC2=CC=C(C=C2)OC(F)(F)F)/[N+](=O)[O-]

InChI

InChI=1S/C19H19F3N2O5S/c1-18(2,3)13-4-10-16(11-5-13)30(27,28)17(24(25)26)12-23-14-6-8-15(9-7-14)29-19(20,21)22/h4-12,23H,1-3H3/b17-12+