sodium 3-quinolin-2-ylsulfanylpropanoate

Systemtic Name: sodium 3-quinolin-2-ylsulfanylpropanoate Openeye Name: sodium 3-(2-quinolylsulfanyl)propanoate CAS Name: sodium 3-(2-quinolinylthio)propanoate IUPAC Name: sodium 3-quinolin-2-ylsulfanylpropanoate Traditional Name: sodium 3-(2-quinolylthio)propionate Formula: C12H10NNaO2S MolecularWeight: 255.26807

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCCC(=O)[O-].[Na+]

InChI

InChI=1S/C12H11NO2S.Na/c14-12(15)7-8-16-11-6-5-9-3-1-2-4-10(9)13-11;/h1-6H,7-8H2,(H,14,15);/q;+1/p-1