4-tert-butylphenol; 2,5-diethylphenol; 4-propan-2-ylphenol

Systemtic Name: 4-tert-butylphenol; 2,5-diethylphenol; 4-propan-2-ylphenol Openeye Name: 4-tert-butylphenol; 2,5-diethylphenol; 4-isopropylphenol CAS Name: 4-tert-butylphenol; 2,5-diethylphenol; 4-propan-2-ylphenol IUPAC Name: 4-tert-butylphenol; 2,5-diethylphenol; 4-propan-2-ylphenol Traditional Name: 4-tert-butylphenol; 2,5-diethylphenol; 4-isopropylphenol Formula: C29H40O3 MolecularWeight: 436.6261

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)O.CC(C)C1=CC=C(C=C1)O.CC(C)(C)C1=CC=C(C=C1)O

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)O.CC(C)C1=CC=C(C=C1)O.CC(C)(C)C1=CC=C(C=C1)O

InChI

InChI=1S/2C10H14O.C9H12O/c1-10(2,3)8-4-6-9(11)7-5-8;1-3-8-5-6-9(4-2)10(11)7-8;1-7(2)8-3-5-9(10)6-4-8/h4-7,11H,1-3H3;5-7,11H,3-4H2,1-2H3;3-7,10H,1-2H3