methyl 2-[3-azanyl-4-(trifluoromethylsulfonyloxy)phenyl]ethanoate

Systemtic Name: methyl 2-[3-azanyl-4-(trifluoromethylsulfonyloxy)phenyl]ethanoate Openeye Name: methyl 2-[3-amino-4-(trifluoromethylsulfonyloxy)phenyl]acetate CAS Name: 2-[3-amino-4-(trifluoromethylsulfonyloxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-amino-4-(trifluoromethylsulfonyloxy)phenyl]acetate Traditional Name: 2-(3-amino-4-triflyloxy-phenyl)acetic acid methyl ester Formula: C10H10F3NO5S MolecularWeight: 313.25031

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)N

Isomeric SMILES

COC(=O)CC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)N

InChI

InChI=1S/C10H10F3NO5S/c1-18-9(15)5-6-2-3-8(7(14)4-6)19-20(16,17)10(11,12)13/h2-4H,5,14H2,1H3