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4-oxidanylidene-2-phenylsulfanyl-pentanal

4-oxidanylidene-2-phenylsulfanyl-pentanal

Systemtic Name:4-oxidanylidene-2-phenylsulfanyl-pentanal
Openeye Name:4-oxo-2-phenylsulfanyl-pentanal
CAS Name:4-oxo-2-(phenylthio)pentanal
IUPAC Name:4-oxo-2-phenylsulfanylpentanal
Traditional Name:4-keto-2-(phenylthio)valeraldehyde
Formula: C11H12O2S
MolecularWeight: 208.27678
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C=O)SC1=CC=CC=C1


Isomeric SMILES

CC(=O)CC(C=O)SC1=CC=CC=C1


InChI

InChI=1S/C11H12O2S/c1-9(13)7-11(8-12)14-10-5-3-2-4-6-10/h2-6,8,11H,7H2,1H3


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