2-nitro-N-(phenylmethyl)-4-(trifluoromethylsulfonyl)aniline

Systemtic Name: 2-nitro-N-(phenylmethyl)-4-(trifluoromethylsulfonyl)aniline Openeye Name: N-benzyl-2-nitro-4-(trifluoromethylsulfonyl)aniline CAS Name: 2-nitro-N-(phenylmethyl)-4-(trifluoromethylsulfonyl)aniline IUPAC Name: N-benzyl-2-nitro-4-(trifluoromethylsulfonyl)aniline Traditional Name: benzyl-(2-nitro-4-triflyl-phenyl)amine Formula: C14H11F3N2O4S MolecularWeight: 360.30835

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11F3N2O4S/c15-14(16,17)24(22,23)11-6-7-12(13(8-11)19(20)21)18-9-10-4-2-1-3-5-10/h1-8,18H,9H2