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

Systemtic Name: 2-(phenylmethylsulfanyl)-2-(2H-pyran-4-yl)propanoic acid Openeye Name: 2-benzylsulfanyl-2-(2H-pyran-4-yl)propanoic acid CAS Name: 2-(phenylmethylthio)-2-(2H-pyran-4-yl)propanoic acid IUPAC Name: 2-benzylsulfanyl-2-(2H-pyran-4-yl)propanoic acid Traditional Name: 2-(benzylthio)-2-(2H-pyran-4-yl)propionic acid Formula: C15H16O3S MolecularWeight: 276.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CCOC=C1)(C(=O)O)SCC2=CC=CC=C2

Isomeric SMILES

CC(C1=CCOC=C1)(C(=O)O)SCC2=CC=CC=C2

InChI

InChI=1S/C15H16O3S/c1-15(14(16)17,13-7-9-18-10-8-13)19-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,16,17)