2-[[7-chloranyl-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfonyl]propanoic acid

Systemtic Name: 2-[[7-chloranyl-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfonyl]propanoic acid Openeye Name: 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfonyl]propanoic acid CAS Name: 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfonyl]propanoic acid IUPAC Name: 2-[[7-chloro-3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfonyl]propanoic acid Traditional Name: 2-[7-chloro-3-(2-fluorophenyl)indoxazen-6-yl]sulfonylpropionic acid Formula: C16H11ClFNO5S MolecularWeight: 383.778643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)C1=C(C2=C(C=C1)C(=NO2)C3=CC=CC=C3F)Cl

Isomeric SMILES

CC(C(=O)O)S(=O)(=O)C1=C(C2=C(C=C1)C(=NO2)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C16H11ClFNO5S/c1-8(16(20)21)25(22,23)12-7-6-10-14(19-24-15(10)13(12)17)9-4-2-3-5-11(9)18/h2-8H,1H3,(H,20,21)