2-[[2-chloranyl-5-(trifluoromethylsulfonyl)phenyl]amino]ethanoic acid

Systemtic Name: 2-[[2-chloranyl-5-(trifluoromethylsulfonyl)phenyl]amino]ethanoic acid Openeye Name: 2-[2-chloro-5-(trifluoromethylsulfonyl)anilino]acetic acid CAS Name: 2-[2-chloro-5-(trifluoromethylsulfonyl)anilino]acetic acid IUPAC Name: 2-[2-chloro-5-(trifluoromethylsulfonyl)anilino]acetic acid Traditional Name: 2-(2-chloro-5-triflyl-anilino)acetic acid Formula: C9H7ClF3NO4S MolecularWeight: 317.66939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)NCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)NCC(=O)O)Cl

InChI

InChI=1S/C9H7ClF3NO4S/c10-6-2-1-5(19(17,18)9(11,12)13)3-7(6)14-4-8(15)16/h1-3,14H,4H2,(H,15,16)