2-[2-[(2-methylphenoxy)methyl]phenyl]-2-oxidanylidene-ethanethioic S-acid

Systemtic Name: 2-[2-[(2-methylphenoxy)methyl]phenyl]-2-oxidanylidene-ethanethioic S-acid Openeye Name: 2-[2-[(2-methylphenoxy)methyl]phenyl]-2-oxo-ethanethioic S-acid CAS Name: 2-[2-[(2-methylphenoxy)methyl]phenyl]-2-oxoethanethioic S-acid IUPAC Name: 2-[2-[(2-methylphenoxy)methyl]phenyl]-2-oxoethanethioic S-acid Traditional Name: 2-keto-2-[2-[(2-methylphenoxy)methyl]phenyl]thioacetic acid Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=CC=CC=C2C(=O)C(=O)S

Isomeric SMILES

CC1=CC=CC=C1OCC2=CC=CC=C2C(=O)C(=O)S

InChI

InChI=1S/C16H14O3S/c1-11-6-2-5-9-14(11)19-10-12-7-3-4-8-13(12)15(17)16(18)20/h2-9H,10H2,1H3,(H,18,20)