N-[(3-fluorophenyl)methyl]-N-methyl-2-nitro-4-(trifluoromethylsulfonyl)aniline

Systemtic Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-nitro-4-(trifluoromethylsulfonyl)aniline Openeye Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-nitro-4-(trifluoromethylsulfonyl)aniline CAS Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-nitro-4-(trifluoromethylsulfonyl)aniline IUPAC Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-nitro-4-(trifluoromethylsulfonyl)aniline Traditional Name: (3-fluorobenzyl)-methyl-(2-nitro-4-triflyl-phenyl)amine Formula: C15H12F4N2O4S MolecularWeight: 392.325393

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F4N2O4S/c1-20(9-10-3-2-4-11(16)7-10)13-6-5-12(8-14(13)21(22)23)26(24,25)15(17,18)19/h2-8H,9H2,1H3