1-[4-(3-oxidanyloct-1-ynyl)phenyl]ethanone

Systemtic Name: 1-[4-(3-oxidanyloct-1-ynyl)phenyl]ethanone Openeye Name: 1-[4-(3-hydroxyoct-1-ynyl)phenyl]ethanone CAS Name: 1-[4-(3-hydroxyoct-1-ynyl)phenyl]ethanone IUPAC Name: 1-[4-(3-hydroxyoct-1-ynyl)phenyl]ethanone Traditional Name: 1-[4-(3-hydroxyoct-1-ynyl)phenyl]ethanone Formula: C16H20O2 MolecularWeight: 244.3288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#CC1=CC=C(C=C1)C(=O)C)O

Isomeric SMILES

CCCCCC(C#CC1=CC=C(C=C1)C(=O)C)O

InChI

InChI=1S/C16H20O2/c1-3-4-5-6-16(18)12-9-14-7-10-15(11-8-14)13(2)17/h7-8,10-11,16,18H,3-6H2,1-2H3