S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ethanethioate

Systemtic Name: S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ethanethioate Openeye Name: S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ethanethioate CAS Name: ethanethioic acid S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ester IUPAC Name: S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ethanethioate Traditional Name: ethanethioic acid S-[3-[4-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]propyl] ester Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCC1=CC=C(C=C1)C2OCC(CO2)(C)C

Isomeric SMILES

CC(=O)SCCCC1=CC=C(C=C1)C2OCC(CO2)(C)C

InChI

InChI=1S/C17H24O3S/c1-13(18)21-10-4-5-14-6-8-15(9-7-14)16-19-11-17(2,3)12-20-16/h6-9,16H,4-5,10-12H2,1-3H3