2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]acetic acid CAS Name: 2-[(4-methoxycarbonylphenyl)methylthio]acetic acid IUPAC Name: 2-[(4-methoxycarbonylphenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-carbomethoxybenzyl)thio]acetic acid Formula: C11H12O4S MolecularWeight: 240.27558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSCC(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSCC(=O)O

InChI

InChI=1S/C11H12O4S/c1-15-11(14)9-4-2-8(3-5-9)6-16-7-10(12)13/h2-5H,6-7H2,1H3,(H,12,13)