2-hydroxyethylsulfanyl quinoline-3-carboxylate

Systemtic Name: 2-hydroxyethylsulfanyl quinoline-3-carboxylate Openeye Name: 2-hydroxyethylsulfanyl quinoline-3-carboxylate CAS Name: 3-quinolinecarboxylic acid (2-hydroxyethylthio) ester IUPAC Name: 2-hydroxyethylsulfanyl quinoline-3-carboxylate Traditional Name: quinoline-3-carboxylic acid (2-hydroxyethylthio) ester Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(=O)OSCCO

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(=O)OSCCO

InChI

InChI=1S/C12H11NO3S/c14-5-6-17-16-12(15)10-7-9-3-1-2-4-11(9)13-8-10/h1-4,7-8,14H,5-6H2