8-phenylsulfanyloctane-2,5-dione

Systemtic Name: 8-phenylsulfanyloctane-2,5-dione Openeye Name: 8-phenylsulfanyloctane-2,5-dione CAS Name: 8-(phenylthio)octane-2,5-dione IUPAC Name: 8-phenylsulfanyloctane-2,5-dione Traditional Name: 8-(phenylthio)octane-2,5-dione Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)CCCSC1=CC=CC=C1

Isomeric SMILES

CC(=O)CCC(=O)CCCSC1=CC=CC=C1

InChI

InChI=1S/C14H18O2S/c1-12(15)9-10-13(16)6-5-11-17-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-11H2,1H3