2-[[4-[(2R)-3-ethoxy-1,1,1-tris(fluoranyl)-2-oxidanyl-3-oxidanylidene-propan-2-yl]-2-methoxy-phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[4-[(2R)-3-ethoxy-1,1,1-tris(fluoranyl)-2-oxidanyl-3-oxidanylidene-propan-2-yl]-2-methoxy-phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[4-[(1R)-1-ethoxycarbonyl-2,2,2-trifluoro-1-hydroxy-ethyl]-2-methoxy-phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[4-[(2R)-3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl]-2-methoxyphenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[4-[(2R)-3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl]-2-methoxyphenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[4-[(1R)-1-carbethoxy-2,2,2-trifluoro-1-hydroxy-ethyl]-2-methoxy-phenyl]iminomethyl]-4-nitro-phenolate Formula: C19H16F3N2O7- MolecularWeight: 441.33475

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(C=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)[C@](C1=CC(=C(C=C1)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])OC)(C(F)(F)F)O

InChI

InChI=1S/C19H17F3N2O7/c1-3-31-17(26)18(27,19(20,21)22)12-4-6-14(16(9-12)30-2)23-10-11-8-13(24(28)29)5-7-15(11)25/h4-10,25,27H,3H2,1-2H3/p-1/t18-/m1/s1