2-(quinolin-2-ylmethylsulfanyl)ethanoate

Systemtic Name: 2-(quinolin-2-ylmethylsulfanyl)ethanoate Openeye Name: 2-(2-quinolylmethylsulfanyl)acetate CAS Name: 2-(2-quinolinylmethylthio)acetate IUPAC Name: 2-(quinolin-2-ylmethylsulfanyl)acetate Traditional Name: 2-(2-quinolylmethylthio)acetate Formula: C12H10NO2S- MolecularWeight: 232.2783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CSCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CSCC(=O)[O-]

InChI

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