hexyl 4-(4-bromophenyl)-4-oxidanylidene-butanoate

Systemtic Name: hexyl 4-(4-bromophenyl)-4-oxidanylidene-butanoate Openeye Name: hexyl 4-(4-bromophenyl)-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-4-oxobutanoic acid hexyl ester IUPAC Name: hexyl 4-(4-bromophenyl)-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-4-keto-butyric acid hexyl ester Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrO3/c1-2-3-4-5-12-20-16(19)11-10-15(18)13-6-8-14(17)9-7-13/h6-9H,2-5,10-12H2,1H3