2-(2-methoxyethylsulfanyl)pyridine-3-carboxylate

Systemtic Name: 2-(2-methoxyethylsulfanyl)pyridine-3-carboxylate Openeye Name: 2-(2-methoxyethylsulfanyl)pyridine-3-carboxylate CAS Name: 2-(2-methoxyethylthio)-3-pyridinecarboxylate IUPAC Name: 2-(2-methoxyethylsulfanyl)pyridine-3-carboxylate Traditional Name: 2-(2-methoxyethylthio)nicotinate Formula: C9H10NO3S- MolecularWeight: 212.2456

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=C(C=CC=N1)C(=O)[O-]

Isomeric SMILES

COCCSC1=C(C=CC=N1)C(=O)[O-]

InChI

InChI=1S/C9H11NO3S/c1-13-5-6-14-8-7(9(11)12)3-2-4-10-8/h2-4H,5-6H2,1H3,(H,11,12)/p-1