4-(6-chloranylquinolin-2-yl)sulfonylbutanoic acid

Systemtic Name: 4-(6-chloranylquinolin-2-yl)sulfonylbutanoic acid Openeye Name: 4-[(6-chloro-2-quinolyl)sulfonyl]butanoic acid CAS Name: 4-[(6-chloro-2-quinolinyl)sulfonyl]butanoic acid IUPAC Name: 4-(6-chloroquinolin-2-yl)sulfonylbutanoic acid Traditional Name: 4-[(6-chloro-2-quinolyl)sulfonyl]butyric acid Formula: C13H12ClNO4S MolecularWeight: 313.75668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=N2)S(=O)(=O)CCCC(=O)O)C=C1Cl

Isomeric SMILES

C1=CC2=C(C=CC(=N2)S(=O)(=O)CCCC(=O)O)C=C1Cl

InChI

InChI=1S/C13H12ClNO4S/c14-10-4-5-11-9(8-10)3-6-12(15-11)20(18,19)7-1-2-13(16)17/h3-6,8H,1-2,7H2,(H,16,17)