2-(oxan-2-yl)-2-sulfanyl-ethanoic acid

Systemtic Name: 2-(oxan-2-yl)-2-sulfanyl-ethanoic acid Openeye Name: 2-sulfanyl-2-tetrahydropyran-2-yl-acetic acid CAS Name: 2-mercapto-2-(2-oxanyl)acetic acid IUPAC Name: 2-(oxan-2-yl)-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-tetrahydropyran-2-yl-acetic acid Formula: C7H12O3S MolecularWeight: 176.23338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C(C(=O)O)S

Isomeric SMILES

C1CCOC(C1)C(C(=O)O)S

InChI

InChI=1S/C7H12O3S/c8-7(9)6(11)5-3-1-2-4-10-5/h5-6,11H,1-4H2,(H,8,9)