2-[[3-(trifluoromethyl)phenyl]carbamoylamino]ethanesulfonic acid

Systemtic Name: 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]ethanesulfonic acid Openeye Name: 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]ethanesulfonic acid CAS Name: 2-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]ethanesulfonic acid IUPAC Name: 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]ethanesulfonic acid Traditional Name: 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]ethanesulfonic acid Formula: C10H11F3N2O4S MolecularWeight: 312.26555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NCCS(=O)(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NCCS(=O)(=O)O)C(F)(F)F

InChI

InChI=1S/C10H11F3N2O4S/c11-10(12,13)7-2-1-3-8(6-7)15-9(16)14-4-5-20(17,18)19/h1-3,6H,4-5H2,(H2,14,15,16)(H,17,18,19)