2-[3-[2-(oxan-2-yloxy)ethyl]phenyl]sulfanylethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-[3-[2-(oxan-2-yloxy)ethyl]phenyl]sulfanylethyl 3-oxidanylidenebutanoate Openeye Name: 2-[3-(2-tetrahydropyran-2-yloxyethyl)phenyl]sulfanylethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-[[3-[2-(2-oxanyloxy)ethyl]phenyl]thio]ethyl ester IUPAC Name: 2-[3-[2-(oxan-2-yloxy)ethyl]phenyl]sulfanylethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-[[3-(2-tetrahydropyran-2-yloxyethyl)phenyl]thio]ethyl ester Formula: C19H26O5S MolecularWeight: 366.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCSC1=CC=CC(=C1)CCOC2CCCCO2

Isomeric SMILES

CC(=O)CC(=O)OCCSC1=CC=CC(=C1)CCOC2CCCCO2

InChI

InChI=1S/C19H26O5S/c1-15(20)13-18(21)22-11-12-25-17-6-4-5-16(14-17)8-10-24-19-7-2-3-9-23-19/h4-6,14,19H,2-3,7-13H2,1H3