2-(3-ethyl-4-methylsulfanyl-phenyl)-2-oxidanylidene-ethanal

Systemtic Name: 2-(3-ethyl-4-methylsulfanyl-phenyl)-2-oxidanylidene-ethanal Openeye Name: 2-(3-ethyl-4-methylsulfanyl-phenyl)-2-oxo-acetaldehyde CAS Name: 2-[3-ethyl-4-(methylthio)phenyl]-2-oxoacetaldehyde IUPAC Name: 2-(3-ethyl-4-methylsulfanylphenyl)-2-oxoacetaldehyde Traditional Name: 2-[3-ethyl-4-(methylthio)phenyl]-2-keto-acetaldehyde Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)C=O)SC

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)C=O)SC

InChI

InChI=1S/C11H12O2S/c1-3-8-6-9(10(13)7-12)4-5-11(8)14-2/h4-7H,3H2,1-2H3