5-bromanyl-2-methyl-2-(4-methylphenyl)hex-5-enal

Systemtic Name: 5-bromanyl-2-methyl-2-(4-methylphenyl)hex-5-enal Openeye Name: 5-bromo-2-methyl-2-(p-tolyl)hex-5-enal CAS Name: 5-bromo-2-methyl-2-(4-methylphenyl)-5-hexenal IUPAC Name: 5-bromo-2-methyl-2-(4-methylphenyl)hex-5-enal Traditional Name: 5-bromo-2-methyl-2-(p-tolyl)hex-5-enal Formula: C14H17BrO MolecularWeight: 281.18818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)(CCC(=C)Br)C=O

Isomeric SMILES

CC1=CC=C(C=C1)C(C)(CCC(=C)Br)C=O

InChI

InChI=1S/C14H17BrO/c1-11-4-6-13(7-5-11)14(3,10-16)9-8-12(2)15/h4-7,10H,2,8-9H2,1,3H3