1-[3,5-bis[1,1-bis(3,5-dimethyl-4-oxidanyl-phenyl)ethyl]phenyl]ethanone

Systemtic Name: 1-[3,5-bis[1,1-bis(3,5-dimethyl-4-oxidanyl-phenyl)ethyl]phenyl]ethanone Openeye Name: 1-[3,5-bis[1,1-bis(4-hydroxy-3,5-dimethyl-phenyl)ethyl]phenyl]ethanone CAS Name: 1-[3,5-bis[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]ethanone IUPAC Name: 1-[3,5-bis[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]ethanone Traditional Name: 1-[3,5-bis[1,1-bis(4-hydroxy-3,5-dimethyl-phenyl)ethyl]phenyl]ethanone Formula: C44H48O5 MolecularWeight: 656.84892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(C)(C2=CC(=C(C(=C2)C)O)C)C3=CC(=CC(=C3)C(=O)C)C(C)(C4=CC(=C(C(=C4)C)O)C)C5=CC(=C(C(=C5)C)O)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(C)(C2=CC(=C(C(=C2)C)O)C)C3=CC(=CC(=C3)C(=O)C)C(C)(C4=CC(=C(C(=C4)C)O)C)C5=CC(=C(C(=C5)C)O)C

InChI

InChI=1S/C44H48O5/c1-23-12-33(13-24(2)39(23)46)43(10,34-14-25(3)40(47)26(4)15-34)37-20-32(31(9)45)21-38(22-37)44(11,35-16-27(5)41(48)28(6)17-35)36-18-29(7)42(49)30(8)19-36/h12-22,46-49H,1-11H3