4-[4,4-bis(5-tert-butyl-2-methyl-4-oxidanyl-phenyl)butan-2-yl]-2-tert-butyl-5-methyl-phenol hydrate

Systemtic Name: 4-[4,4-bis(5-tert-butyl-2-methyl-4-oxidanyl-phenyl)butan-2-yl]-2-tert-butyl-5-methyl-phenol hydrate Openeye Name: 4-[3,3-bis(5-tert-butyl-4-hydroxy-2-methyl-phenyl)-1-methyl-propyl]-2-tert-butyl-5-methyl-phenol hydrate CAS Name: 4-[4,4-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)butan-2-yl]-2-tert-butyl-5-methylphenol hydrate IUPAC Name: 4-[4,4-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)butan-2-yl]-2-tert-butyl-5-methylphenol hydrate Traditional Name: 4-[3,3-bis(5-tert-butyl-4-hydroxy-2-methyl-phenyl)-1-methyl-propyl]-2-tert-butyl-5-methyl-phenol hydrate Formula: C37H54O4 MolecularWeight: 562.82226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)O)C(C)(C)C)C3=CC(=C(C=C3C)O)C(C)(C)C)C(C)(C)C)O.O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)O)C(C)(C)C)C3=CC(=C(C=C3C)O)C(C)(C)C)C(C)(C)C)O.O

InChI

InChI=1S/C37H52O3.H2O/c1-21(25-18-29(35(5,6)7)32(38)15-22(25)2)14-28(26-19-30(36(8,9)10)33(39)16-23(26)3)27-20-31(37(11,12)13)34(40)17-24(27)4;/h15-21,28,38-40H,14H2,1-13H3;1H2