(3-carboxy-4H-quinolin-3-yl)-dimethyl-sulfanylcarbonyl-azanium

Systemtic Name: (3-carboxy-4H-quinolin-3-yl)-dimethyl-sulfanylcarbonyl-azanium Openeye Name: (3-carboxy-4H-quinolin-3-yl)-dimethyl-sulfanylcarbonyl-ammonium CAS Name: (3-carboxy-4H-quinolin-3-yl)-[mercapto(oxo)methyl]-dimethylammonium IUPAC Name: (3-carboxy-4H-quinolin-3-yl)-dimethyl-sulfanylcarbonylazanium Traditional Name: (3-carboxy-4H-quinolin-3-yl)-dimethyl-thiocarboxy-ammonium Formula: C13H15N2O3S+ MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C(=O)S)C1(CC2=CC=CC=C2N=C1)C(=O)O

Isomeric SMILES

C[N+](C)(C(=O)S)C1(CC2=CC=CC=C2N=C1)C(=O)O

InChI

InChI=1S/C13H14N2O3S/c1-15(2,12(18)19)13(11(16)17)7-9-5-3-4-6-10(9)14-8-13/h3-6,8H,7H2,1-2H3,(H-,16,17,18,19)/p+1