2-heptan-2-yl-6-[[3-heptan-2-yl-2-oxidanyl-5-(4-phenylphenyl)phenyl]methylsulfanylmethyl]-4-(4-phenylphenyl)phenol

Systemtic Name: 2-heptan-2-yl-6-[[3-heptan-2-yl-2-oxidanyl-5-(4-phenylphenyl)phenyl]methylsulfanylmethyl]-4-(4-phenylphenyl)phenol Openeye Name: 2-[[2-hydroxy-3-(1-methylhexyl)-5-(4-phenylphenyl)phenyl]methylsulfanylmethyl]-6-(1-methylhexyl)-4-(4-phenylphenyl)phenol CAS Name: 2-heptan-2-yl-6-[[[3-heptan-2-yl-2-hydroxy-5-(4-phenylphenyl)phenyl]methylthio]methyl]-4-(4-phenylphenyl)phenol IUPAC Name: 2-heptan-2-yl-6-[[3-heptan-2-yl-2-hydroxy-5-(4-phenylphenyl)phenyl]methylsulfanylmethyl]-4-(4-phenylphenyl)phenol Traditional Name: 2-[[[2-hydroxy-3-(1-methylhexyl)-5-(4-phenylphenyl)benzyl]thio]methyl]-6-(1-methylhexyl)-4-(4-phenylphenyl)phenol Formula: C52H58O2S MolecularWeight: 747.08072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1=CC(=CC(=C1O)CSCC2=C(C(=CC(=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C(C)CCCCC)O)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CCCCCC(C)C1=CC(=CC(=C1O)CSCC2=C(C(=CC(=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C(C)CCCCC)O)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C52H58O2S/c1-5-7-11-17-37(3)49-33-45(43-27-23-41(24-28-43)39-19-13-9-14-20-39)31-47(51(49)53)35-55-36-48-32-46(34-50(52(48)54)38(4)18-12-8-6-2)44-29-25-42(26-30-44)40-21-15-10-16-22-40/h9-10,13-16,19-34,37-38,53-54H,5-8,11-12,17-18,35-36H2,1-4H3