4-[(E)-2-[1-ethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-yl]ethenyl]-N,N-dimethyl-2-nitro-aniline

Systemtic Name: 4-[(E)-2-[1-ethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-yl]ethenyl]-N,N-dimethyl-2-nitro-aniline Openeye Name: 4-[(E)-2-[1-ethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-yl]vinyl]-N,N-dimethyl-2-nitro-aniline CAS Name: 4-[(E)-2-[1-ethyl-5-(trifluoromethylsulfonyl)-2-benzimidazolyl]ethenyl]-N,N-dimethyl-2-nitroaniline IUPAC Name: 4-[(E)-2-[1-ethyl-5-(trifluoromethylsulfonyl)benzimidazol-2-yl]ethenyl]-N,N-dimethyl-2-nitroaniline Traditional Name: [4-[(E)-2-(1-ethyl-5-triflyl-benzimidazol-2-yl)vinyl]-2-nitro-phenyl]-dimethyl-amine Formula: C20H19F3N4O4S MolecularWeight: 468.44947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)N=C1C=CC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)N=C1/C=C/C3=CC(=C(C=C3)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H19F3N4O4S/c1-4-26-16-9-7-14(32(30,31)20(21,22)23)12-15(16)24-19(26)10-6-13-5-8-17(25(2)3)18(11-13)27(28)29/h5-12H,4H2,1-3H3/b10-6+