2-butyl-4-methyl-phenol; 2,6-ditert-butyl-4-methyl-phenol

Systemtic Name: 2-butyl-4-methyl-phenol; 2,6-ditert-butyl-4-methyl-phenol Openeye Name: 2-butyl-4-methyl-phenol; 2,6-ditert-butyl-4-methyl-phenol CAS Name: 2-butyl-4-methylphenol; 2,6-ditert-butyl-4-methylphenol IUPAC Name: 2-butyl-4-methylphenol; 2,6-ditert-butyl-4-methylphenol Traditional Name: 2-butyl-4-methyl-phenol; 2,6-ditert-butyl-4-methyl-phenol Formula: C26H40O2 MolecularWeight: 384.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C)O.CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C)O.CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C15H24O.C11H16O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7;1-3-4-5-10-8-9(2)6-7-11(10)12/h8-9,16H,1-7H3;6-8,12H,3-5H2,1-2H3