1-(2-hydroxyethylsulfanyl)-4-methyl-1-phenyl-pentan-3-one

Systemtic Name: 1-(2-hydroxyethylsulfanyl)-4-methyl-1-phenyl-pentan-3-one Openeye Name: 1-(2-hydroxyethylsulfanyl)-4-methyl-1-phenyl-pentan-3-one CAS Name: 1-(2-hydroxyethylthio)-4-methyl-1-phenyl-3-pentanone IUPAC Name: 1-(2-hydroxyethylsulfanyl)-4-methyl-1-phenylpentan-3-one Traditional Name: 1-(2-hydroxyethylthio)-4-methyl-1-phenyl-pentan-3-one Formula: C14H20O2S MolecularWeight: 252.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CC(C1=CC=CC=C1)SCCO

Isomeric SMILES

CC(C)C(=O)CC(C1=CC=CC=C1)SCCO

InChI

InChI=1S/C14H20O2S/c1-11(2)13(16)10-14(17-9-8-15)12-6-4-3-5-7-12/h3-7,11,14-15H,8-10H2,1-2H3