6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-[2-cyanoethyl(methyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-[2-cyanoethyl(methyl)sulfamoyl]-4-keto-1H-quinoline-3-carboxylic acid Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)S(=O)(=O)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)O

Isomeric SMILES

CN(CCC#N)S(=O)(=O)C1=CC2=C(C=C1)NC=C(C2=O)C(=O)O

InChI

InChI=1S/C14H13N3O5S/c1-17(6-2-5-15)23(21,22)9-3-4-12-10(7-9)13(18)11(8-16-12)14(19)20/h3-4,7-8H,2,6H2,1H3,(H,16,18)(H,19,20)