1,3-diphenylnon-4-yn-1-one

Systemtic Name: 1,3-diphenylnon-4-yn-1-one Openeye Name: 1,3-diphenylnon-4-yn-1-one CAS Name: 1,3-diphenyl-4-nonyn-1-one IUPAC Name: 1,3-diphenylnon-4-yn-1-one Traditional Name: 1,3-diphenylnon-4-yn-1-one Formula: C21H22O MolecularWeight: 290.39878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCC#CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H22O/c1-2-3-4-7-16-20(18-12-8-5-9-13-18)17-21(22)19-14-10-6-11-15-19/h5-6,8-15,20H,2-4,17H2,1H3