1-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-prop-2-enyl-amino]ethanol

Systemtic Name: 1-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-prop-2-enyl-amino]ethanol Openeye Name: 1-[N-allyl-2,6-dinitro-4-(trifluoromethyl)anilino]ethanol CAS Name: 1-[2,6-dinitro-N-prop-2-enyl-4-(trifluoromethyl)anilino]ethanol IUPAC Name: 1-[2,6-dinitro-N-prop-2-enyl-4-(trifluoromethyl)anilino]ethanol Traditional Name: 1-[N-allyl-2,6-dinitro-4-(trifluoromethyl)anilino]ethanol Formula: C12H12F3N3O5 MolecularWeight: 335.23599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3N3O5/c1-3-4-16(7(2)19)11-9(17(20)21)5-8(12(13,14)15)6-10(11)18(22)23/h3,5-7,19H,1,4H2,2H3