4-chloranyl-3,5-dimethyl-2-pentyl-phenol

Systemtic Name: 4-chloranyl-3,5-dimethyl-2-pentyl-phenol Openeye Name: 4-chloro-3,5-dimethyl-2-pentyl-phenol CAS Name: 4-chloro-3,5-dimethyl-2-pentylphenol IUPAC Name: 4-chloro-3,5-dimethyl-2-pentylphenol Traditional Name: 2-amyl-4-chloro-3,5-dimethyl-phenol Formula: C13H19ClO MolecularWeight: 226.74236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C(=C1C)Cl)C)O

Isomeric SMILES

CCCCCC1=C(C=C(C(=C1C)Cl)C)O

InChI

InChI=1S/C13H19ClO/c1-4-5-6-7-11-10(3)13(14)9(2)8-12(11)15/h8,15H,4-7H2,1-3H3