S-[3-(4-methanoylphenyl)propyl] ethanethioate

Systemtic Name: S-[3-(4-methanoylphenyl)propyl] ethanethioate Openeye Name: S-[3-(4-formylphenyl)propyl] ethanethioate CAS Name: ethanethioic acid S-[3-(4-formylphenyl)propyl] ester IUPAC Name: S-[3-(4-formylphenyl)propyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(4-formylphenyl)propyl] ester Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCC1=CC=C(C=C1)C=O

Isomeric SMILES

CC(=O)SCCCC1=CC=C(C=C1)C=O

InChI

InChI=1S/C12H14O2S/c1-10(14)15-8-2-3-11-4-6-12(9-13)7-5-11/h4-7,9H,2-3,8H2,1H3