2-propan-2-yloxyethyl 4-phenylsulfanylbutanoate

Systemtic Name: 2-propan-2-yloxyethyl 4-phenylsulfanylbutanoate Openeye Name: 2-isopropoxyethyl 4-phenylsulfanylbutanoate CAS Name: 4-(phenylthio)butanoic acid 2-propan-2-yloxyethyl ester IUPAC Name: 2-propan-2-yloxyethyl 4-phenylsulfanylbutanoate Traditional Name: 4-(phenylthio)butyric acid 2-isopropoxyethyl ester Formula: C15H22O3S MolecularWeight: 282.39838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCOC(=O)CCCSC1=CC=CC=C1

Isomeric SMILES

CC(C)OCCOC(=O)CCCSC1=CC=CC=C1

InChI

InChI=1S/C15H22O3S/c1-13(2)17-10-11-18-15(16)9-6-12-19-14-7-4-3-5-8-14/h3-5,7-8,13H,6,9-12H2,1-2H3