1-[(4-nitrophenyl)amino]-3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]propan-2-ol

Systemtic Name: 1-[(4-nitrophenyl)amino]-3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]propan-2-ol Openeye Name: 1-(4-nitroanilino)-3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]propan-2-ol CAS Name: 1-(4-nitroanilino)-3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]-2-propanol IUPAC Name: 1-(4-nitroanilino)-3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]propan-2-ol Traditional Name: 1-(4-nitroanilino)-3-(2-nitro-4-triflyl-phenoxy)propan-2-ol Formula: C16H14F3N3O8S MolecularWeight: 465.35787

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC(COC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCC(COC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C16H14F3N3O8S/c17-16(18,19)31(28,29)13-5-6-15(14(7-13)22(26)27)30-9-12(23)8-20-10-1-3-11(4-2-10)21(24)25/h1-7,12,20,23H,8-9H2