(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C13H12ClN3O4S MolecularWeight: 341.77008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

CN1C=NC(=C1Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C13H12ClN3O4S/c1-17-7-15-13(12(17)14)22(19,20)21-9-3-4-10-8(6-9)2-5-11(18)16-10/h3-4,6-7H,2,5H2,1H3,(H,16,18)