[[1-methoxy-1-oxidanylidene-3-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-oxidanylidene-methanesulfonate

Systemtic Name: [[1-methoxy-1-oxidanylidene-3-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-oxidanylidene-methanesulfonate Openeye Name: [[2-methoxy-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]ethyl]amino]-oxo-methanesulfonate CAS Name: [[1-methoxy-1-oxo-3-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-oxomethanesulfonate IUPAC Name: [[1-methoxy-1-oxo-3-[3-(trifluoromethyl)phenyl]propan-2-yl]amino]-oxomethanesulfonate Traditional Name: keto-[[2-keto-2-methoxy-1-[3-(trifluoromethyl)benzyl]ethyl]amino]methanesulfonate Formula: C12H11F3NO6S- MolecularWeight: 354.27905

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)S(=O)(=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)S(=O)(=O)[O-]

InChI

InChI=1S/C12H12F3NO6S/c1-22-10(17)9(16-11(18)23(19,20)21)6-7-3-2-4-8(5-7)12(13,14)15/h2-5,9H,6H2,1H3,(H,16,18)(H,19,20,21)/p-1