2-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-2-(4-methyl-3-oxidanylidene-quinoxalin-2-yl)ethanoic acid

Systemtic Name: 2-(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-2-(4-methyl-3-oxidanylidene-quinoxalin-2-yl)ethanoic acid Openeye Name: 2-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-2-(4-methyl-3-oxo-quinoxalin-2-yl)acetic acid CAS Name: 2-(4-chloro-2,5-dimethylphenyl)sulfonyl-2-(4-methyl-3-oxo-2-quinoxalinyl)acetic acid IUPAC Name: 2-(4-chloro-2,5-dimethylphenyl)sulfonyl-2-(4-methyl-3-oxoquinoxalin-2-yl)acetic acid Traditional Name: 2-(4-chloro-2,5-dimethyl-phenyl)sulfonyl-2-(3-keto-4-methyl-quinoxalin-2-yl)acetic acid Formula: C19H17ClN2O5S MolecularWeight: 420.86668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)C(C2=NC3=CC=CC=C3N(C2=O)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)C(C2=NC3=CC=CC=C3N(C2=O)C)C(=O)O

InChI

InChI=1S/C19H17ClN2O5S/c1-10-9-15(11(2)8-12(10)20)28(26,27)17(19(24)25)16-18(23)22(3)14-7-5-4-6-13(14)21-16/h4-9,17H,1-3H3,(H,24,25)