phenacyl 2-ethylsulfanylbenzoate

Systemtic Name: phenacyl 2-ethylsulfanylbenzoate Openeye Name: phenacyl 2-ethylsulfanylbenzoate CAS Name: 2-(ethylthio)benzoic acid phenacyl ester IUPAC Name: phenacyl 2-ethylsulfanylbenzoate Traditional Name: 2-(ethylthio)benzoic acid phenacyl ester Formula: C17H16O3S MolecularWeight: 300.37214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16O3S/c1-2-21-16-11-7-6-10-14(16)17(19)20-12-15(18)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3