2-butylsulfanyl-1-(5-methyl-2-oxidanyl-phenyl)dodecan-1-one

Systemtic Name: 2-butylsulfanyl-1-(5-methyl-2-oxidanyl-phenyl)dodecan-1-one Openeye Name: 2-butylsulfanyl-1-(2-hydroxy-5-methyl-phenyl)dodecan-1-one CAS Name: 2-(butylthio)-1-(2-hydroxy-5-methylphenyl)-1-dodecanone IUPAC Name: 2-butylsulfanyl-1-(2-hydroxy-5-methylphenyl)dodecan-1-one Traditional Name: 2-(butylthio)-1-(2-hydroxy-5-methyl-phenyl)dodecan-1-one Formula: C23H38O2S MolecularWeight: 378.61162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)C1=C(C=CC(=C1)C)O)SCCCC

Isomeric SMILES

CCCCCCCCCCC(C(=O)C1=C(C=CC(=C1)C)O)SCCCC

InChI

InChI=1S/C23H38O2S/c1-4-6-8-9-10-11-12-13-14-22(26-17-7-5-2)23(25)20-18-19(3)15-16-21(20)24/h15-16,18,22,24H,4-14,17H2,1-3H3