[4-(4-azanylideneboranyloxy-3-methyl-phenyl)-2-methanoyl-3,6-dimethoxy-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(4-azanylideneboranyloxy-3-methyl-phenyl)-2-methanoyl-3,6-dimethoxy-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-formyl-4-(4-iminoboranyloxy-3-methyl-phenyl)-3,6-dimethoxy-phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-formyl-4-(4-iminoboranyloxy-3-methylphenyl)-3,6-dimethoxyphenyl] ester IUPAC Name: [2-formyl-4-(4-iminoboranyloxy-3-methylphenyl)-3,6-dimethoxyphenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-formyl-4-(4-iminoboranyloxy-3-methyl-phenyl)-3,6-dimethoxy-phenyl] ester Formula: C17H15BF3NO7S MolecularWeight: 445.17471

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Descriptors Computed from Structure

Canonical SMILES:

B(=N)OC1=C(C=C(C=C1)C2=CC(=C(C(=C2OC)C=O)OS(=O)(=O)C(F)(F)F)OC)C

Isomeric SMILES

B(=N)OC1=C(C=C(C=C1)C2=CC(=C(C(=C2OC)C=O)OS(=O)(=O)C(F)(F)F)OC)C

InChI

InChI=1S/C17H15BF3NO7S/c1-9-6-10(4-5-13(9)28-18-22)11-7-14(26-2)16(12(8-23)15(11)27-3)29-30(24,25)17(19,20)21/h4-8,22H,1-3H3