2-(phenylmethylsulfanyl)-2-(2H-pyran-4-yl)ethanoic acid

Systemtic Name: 2-(phenylmethylsulfanyl)-2-(2H-pyran-4-yl)ethanoic acid Openeye Name: 2-benzylsulfanyl-2-(2H-pyran-4-yl)acetic acid CAS Name: 2-(phenylmethylthio)-2-(2H-pyran-4-yl)acetic acid IUPAC Name: 2-benzylsulfanyl-2-(2H-pyran-4-yl)acetic acid Traditional Name: 2-(benzylthio)-2-(2H-pyran-4-yl)acetic acid Formula: C14H14O3S MolecularWeight: 262.32416

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CO1)C(C(=O)O)SCC2=CC=CC=C2

Isomeric SMILES

C1C=C(C=CO1)C(C(=O)O)SCC2=CC=CC=C2

InChI

InChI=1S/C14H14O3S/c15-14(16)13(12-6-8-17-9-7-12)18-10-11-4-2-1-3-5-11/h1-8,13H,9-10H2,(H,15,16)