2-[2-(methylsulfonylamino)ethylamino]quinoline-4-carboxylic acid

Systemtic Name: 2-[2-(methylsulfonylamino)ethylamino]quinoline-4-carboxylic acid Openeye Name: 2-[2-(methanesulfonamido)ethylamino]quinoline-4-carboxylic acid CAS Name: 2-[2-(methanesulfonamido)ethylamino]-4-quinolinecarboxylic acid IUPAC Name: 2-[2-(methanesulfonamido)ethylamino]quinoline-4-carboxylic acid Traditional Name: 2-[2-(methanesulfonamido)ethylamino]cinchoninic acid Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCNC1=NC2=CC=CC=C2C(=C1)C(=O)O

Isomeric SMILES

CS(=O)(=O)NCCNC1=NC2=CC=CC=C2C(=C1)C(=O)O

InChI

InChI=1S/C13H15N3O4S/c1-21(19,20)15-7-6-14-12-8-10(13(17)18)9-4-2-3-5-11(9)16-12/h2-5,8,15H,6-7H2,1H3,(H,14,16)(H,17,18)