2-bromanyl-1-(4-prop-1-ynylphenyl)pentan-1-one

Systemtic Name: 2-bromanyl-1-(4-prop-1-ynylphenyl)pentan-1-one Openeye Name: 2-bromo-1-(4-prop-1-ynylphenyl)pentan-1-one CAS Name: 2-bromo-1-(4-prop-1-ynylphenyl)-1-pentanone IUPAC Name: 2-bromo-1-(4-prop-1-ynylphenyl)pentan-1-one Traditional Name: 2-bromo-1-(4-prop-1-ynylphenyl)pentan-1-one Formula: C14H15BrO MolecularWeight: 279.1723

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=CC=C(C=C1)C#CC)Br

Isomeric SMILES

CCCC(C(=O)C1=CC=C(C=C1)C#CC)Br

InChI

InChI=1S/C14H15BrO/c1-3-5-11-7-9-12(10-8-11)14(16)13(15)6-4-2/h7-10,13H,4,6H2,1-2H3