methyl 4-(2-methanoylphenyl)sulfanylbutanoate

Systemtic Name: methyl 4-(2-methanoylphenyl)sulfanylbutanoate Openeye Name: methyl 4-(2-formylphenyl)sulfanylbutanoate CAS Name: 4-[(2-formylphenyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(2-formylphenyl)sulfanylbutanoate Traditional Name: 4-[(2-formylphenyl)thio]butyric acid methyl ester Formula: C12H14O3S MolecularWeight: 238.30276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=CC=CC=C1C=O

Isomeric SMILES

COC(=O)CCCSC1=CC=CC=C1C=O

InChI

InChI=1S/C12H14O3S/c1-15-12(14)7-4-8-16-11-6-3-2-5-10(11)9-13/h2-3,5-6,9H,4,7-8H2,1H3