2-(pyridin-3-ylmethylsulfonyl)ethanoic acid hydrochloride

Systemtic Name: 2-(pyridin-3-ylmethylsulfonyl)ethanoic acid hydrochloride Openeye Name: 2-(3-pyridylmethylsulfonyl)acetic acid hydrochloride CAS Name: 2-(3-pyridinylmethylsulfonyl)acetic acid hydrochloride IUPAC Name: 2-(pyridin-3-ylmethylsulfonyl)acetic acid hydrochloride Traditional Name: 2-(3-pyridylmethylsulfonyl)acetic acid hydrochloride Formula: C8H10ClNO4S MolecularWeight: 251.6873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CS(=O)(=O)CC(=O)O.Cl

Isomeric SMILES

C1=CC(=CN=C1)CS(=O)(=O)CC(=O)O.Cl

InChI

InChI=1S/C8H9NO4S.ClH/c10-8(11)6-14(12,13)5-7-2-1-3-9-4-7;/h1-4H,5-6H2,(H,10,11);1H