1-octyl-4-(phenylsulfanyloxymethyl)benzene

Systemtic Name: 1-octyl-4-(phenylsulfanyloxymethyl)benzene Openeye Name: 1-octyl-4-(phenylsulfanyloxymethyl)benzene CAS Name: benzenesulfenic acid (4-octylphenyl)methyl ester IUPAC Name: 1-octyl-4-(phenylsulfanyloxymethyl)benzene Traditional Name: 1-octyl-4-[(phenylthio)oxymethyl]benzene Formula: C21H28OS MolecularWeight: 328.51142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)COSC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)COSC2=CC=CC=C2

InChI

InChI=1S/C21H28OS/c1-2-3-4-5-6-8-11-19-14-16-20(17-15-19)18-22-23-21-12-9-7-10-13-21/h7,9-10,12-17H,2-6,8,11,18H2,1H3