2-ethynyl-1-phenyl-hexan-1-ol

Systemtic Name: 2-ethynyl-1-phenyl-hexan-1-ol Openeye Name: 2-ethynyl-1-phenyl-hexan-1-ol CAS Name: 2-ethynyl-1-phenyl-1-hexanol IUPAC Name: 2-ethynyl-1-phenylhexan-1-ol Traditional Name: 2-butyl-1-phenyl-but-3-yn-1-ol Formula: C14H18O MolecularWeight: 202.29212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C#C)C(C1=CC=CC=C1)O

Isomeric SMILES

CCCCC(C#C)C(C1=CC=CC=C1)O

InChI

InChI=1S/C14H18O/c1-3-5-9-12(4-2)14(15)13-10-7-6-8-11-13/h2,6-8,10-12,14-15H,3,5,9H2,1H3