3-butyl-4-hex-1-ynyl-5-phenyl-phenol

Systemtic Name: 3-butyl-4-hex-1-ynyl-5-phenyl-phenol Openeye Name: 3-butyl-4-hex-1-ynyl-5-phenyl-phenol CAS Name: 3-butyl-4-hex-1-ynyl-5-phenylphenol IUPAC Name: 3-butyl-4-hex-1-ynyl-5-phenylphenol Traditional Name: 3-butyl-4-hex-1-ynyl-5-phenyl-phenol Formula: C22H26O MolecularWeight: 306.44124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=C(C=C1C2=CC=CC=C2)O)CCCC

Isomeric SMILES

CCCCC#CC1=C(C=C(C=C1C2=CC=CC=C2)O)CCCC

InChI

InChI=1S/C22H26O/c1-3-5-7-11-15-21-19(12-6-4-2)16-20(23)17-22(21)18-13-9-8-10-14-18/h8-10,13-14,16-17,23H,3-7,12H2,1-2H3