4-(4-acetamidophenyl)sulfanylbutanoate

Systemtic Name: 4-(4-acetamidophenyl)sulfanylbutanoate Openeye Name: 4-(4-acetamidophenyl)sulfanylbutanoate CAS Name: 4-[(4-acetamidophenyl)thio]butanoate IUPAC Name: 4-(4-acetamidophenyl)sulfanylbutanoate Traditional Name: 4-[(4-acetamidophenyl)thio]butyrate Formula: C12H14NO3S- MolecularWeight: 252.30946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCCCC(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCCCC(=O)[O-]

InChI

InChI=1S/C12H15NO3S/c1-9(14)13-10-4-6-11(7-5-10)17-8-2-3-12(15)16/h4-7H,2-3,8H2,1H3,(H,13,14)(H,15,16)/p-1