4-(4-ethylsulfanylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(4-ethylsulfanylphenyl)-4-oxidanylidene-butanoate Openeye Name: 4-(4-ethylsulfanylphenyl)-4-oxo-butanoate CAS Name: 4-[4-(ethylthio)phenyl]-4-oxobutanoate IUPAC Name: 4-(4-ethylsulfanylphenyl)-4-oxobutanoate Traditional Name: 4-[4-(ethylthio)phenyl]-4-keto-butyrate Formula: C12H13O3S- MolecularWeight: 237.29482

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H14O3S/c1-2-16-10-5-3-9(4-6-10)11(13)7-8-12(14)15/h3-6H,2,7-8H2,1H3,(H,14,15)/p-1