2-(3-chloranylbut-3-en-1-ynyl)-1-phenyl-heptan-1-one

Systemtic Name: 2-(3-chloranylbut-3-en-1-ynyl)-1-phenyl-heptan-1-one Openeye Name: 2-(3-chlorobut-3-en-1-ynyl)-1-phenyl-heptan-1-one CAS Name: 2-(3-chlorobut-3-en-1-ynyl)-1-phenyl-1-heptanone IUPAC Name: 2-(3-chlorobut-3-en-1-ynyl)-1-phenylheptan-1-one Traditional Name: 2-amyl-5-chloro-1-phenyl-hex-5-en-3-yn-1-one Formula: C17H19ClO MolecularWeight: 274.78516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClO/c1-3-4-6-9-16(13-12-14(2)18)17(19)15-10-7-5-8-11-15/h5,7-8,10-11,16H,2-4,6,9H2,1H3