2-methyl-6-nitro-4-[(2S)-1,1,1-tris(fluoranyl)-3-methoxy-2-oxidanyl-3-oxidanylidene-propan-2-yl]phenolate

Systemtic Name: 2-methyl-6-nitro-4-[(2S)-1,1,1-tris(fluoranyl)-3-methoxy-2-oxidanyl-3-oxidanylidene-propan-2-yl]phenolate Openeye Name: 2-methyl-6-nitro-4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methoxycarbonyl-ethyl]phenolate CAS Name: 2-methyl-6-nitro-4-[(2S)-1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl]phenolate IUPAC Name: 2-methyl-6-nitro-4-[(2S)-1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl]phenolate Traditional Name: 4-[(1S)-1-carbomethoxy-2,2,2-trifluoro-1-hydroxy-ethyl]-2-methyl-6-nitro-phenolate Formula: C11H9F3NO6- MolecularWeight: 308.18747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=C(C(=CC(=C1)[C@](C(=O)OC)(C(F)(F)F)O)[N+](=O)[O-])[O-]

InChI

InChI=1S/C11H10F3NO6/c1-5-3-6(4-7(8(5)16)15(19)20)10(18,9(17)21-2)11(12,13)14/h3-4,16,18H,1-2H3/p-1/t10-/m0/s1