N'-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]ethane-1,2-diamine

Systemtic Name: N'-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]ethane-1,2-diamine Openeye Name: N'-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]ethane-1,2-diamine CAS Name: N'-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]ethane-1,2-diamine IUPAC Name: N'-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-(2-nitro-4-triflyl-phenyl)amine Formula: C9H10F3N3O4S MolecularWeight: 313.25361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)[N+](=O)[O-])NCCN

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)[N+](=O)[O-])NCCN

InChI

InChI=1S/C9H10F3N3O4S/c10-9(11,12)20(18,19)6-1-2-7(14-4-3-13)8(5-6)15(16)17/h1-2,5,14H,3-4,13H2