4-[3,5-bis(2,3,5-trimethyl-4-oxidanyl-phenyl)-1-adamantyl]-2,3,6-trimethyl-phenol

Systemtic Name: 4-[3,5-bis(2,3,5-trimethyl-4-oxidanyl-phenyl)-1-adamantyl]-2,3,6-trimethyl-phenol Openeye Name: 4-[3,5-bis(4-hydroxy-2,3,5-trimethyl-phenyl)-1-adamantyl]-2,3,6-trimethyl-phenol CAS Name: 4-[3,5-bis(4-hydroxy-2,3,5-trimethylphenyl)-1-adamantyl]-2,3,6-trimethylphenol IUPAC Name: 4-[3,5-bis(4-hydroxy-2,3,5-trimethylphenyl)-1-adamantyl]-2,3,6-trimethylphenol Traditional Name: 4-[3,5-bis(4-hydroxy-2,3,5-trimethyl-phenyl)-1-adamantyl]-2,3,6-trimethyl-phenol Formula: C37H46O3 MolecularWeight: 538.75934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C23CC4CC(C2)(CC(C4)(C3)C5=CC(=C(C(=C5C)C)O)C)C6=CC(=C(C(=C6C)C)O)C)C)C)O

Isomeric SMILES

CC1=C(C(=C(C(=C1)C23CC4CC(C2)(CC(C4)(C3)C5=CC(=C(C(=C5C)C)O)C)C6=CC(=C(C(=C6C)C)O)C)C)C)O

InChI

InChI=1S/C37H46O3/c1-19-10-29(22(4)25(7)32(19)38)35-13-28-14-36(16-35,30-11-20(2)33(39)26(8)23(30)5)18-37(15-28,17-35)31-12-21(3)34(40)27(9)24(31)6/h10-12,28,38-40H,13-18H2,1-9H3