1-[[2-nitro-4-(trifluoromethyl)phenyl]amino]but-3-ene-1,2-diol

Systemtic Name: 1-[[2-nitro-4-(trifluoromethyl)phenyl]amino]but-3-ene-1,2-diol Openeye Name: 1-[2-nitro-4-(trifluoromethyl)anilino]but-3-ene-1,2-diol CAS Name: 1-[2-nitro-4-(trifluoromethyl)anilino]-3-butene-1,2-diol IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)anilino]but-3-ene-1,2-diol Traditional Name: 1-[2-nitro-4-(trifluoromethyl)anilino]but-3-ene-1,2-diol Formula: C11H11F3N2O4 MolecularWeight: 292.21125

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])O)O

Isomeric SMILES

C=CC(C(NC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])O)O

InChI

InChI=1S/C11H11F3N2O4/c1-2-9(17)10(18)15-7-4-3-6(11(12,13)14)5-8(7)16(19)20/h2-5,9-10,15,17-18H,1H2