6-methyl-6-oxidanyl-1,9-bis[(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl]nonan-4-one

Systemtic Name: 6-methyl-6-oxidanyl-1,9-bis[(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl]nonan-4-one Openeye Name: 6-hydroxy-1,9-bis[(4-hydroxy-3,5-diphenyl-phenyl)sulfanyl]-6-methyl-nonan-4-one CAS Name: 6-hydroxy-1,9-bis[(4-hydroxy-3,5-diphenylphenyl)thio]-6-methyl-4-nonanone IUPAC Name: 6-hydroxy-1,9-bis[(4-hydroxy-3,5-diphenylphenyl)sulfanyl]-6-methylnonan-4-one Traditional Name: 6-hydroxy-1,9-bis[(4-hydroxy-3,5-diphenyl-phenyl)thio]-6-methyl-nonan-4-one Formula: C46H44O4S2 MolecularWeight: 724.96916

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCSC1=CC(=C(C(=C1)C2=CC=CC=C2)O)C3=CC=CC=C3)(CC(=O)CCCSC4=CC(=C(C(=C4)C5=CC=CC=C5)O)C6=CC=CC=C6)O

Isomeric SMILES

CC(CCCSC1=CC(=C(C(=C1)C2=CC=CC=C2)O)C3=CC=CC=C3)(CC(=O)CCCSC4=CC(=C(C(=C4)C5=CC=CC=C5)O)C6=CC=CC=C6)O

InChI

InChI=1S/C46H44O4S2/c1-46(50,25-15-27-52-39-30-42(35-20-10-4-11-21-35)45(49)43(31-39)36-22-12-5-13-23-36)32-37(47)24-14-26-51-38-28-40(33-16-6-2-7-17-33)44(48)41(29-38)34-18-8-3-9-19-34/h2-13,16-23,28-31,48-50H,14-15,24-27,32H2,1H3