2-[3-(4-bromophenyl)-3-oxidanylidene-propyl]heptanal

Systemtic Name: 2-[3-(4-bromophenyl)-3-oxidanylidene-propyl]heptanal Openeye Name: 2-[3-(4-bromophenyl)-3-oxo-propyl]heptanal CAS Name: 2-[3-(4-bromophenyl)-3-oxopropyl]heptanal IUPAC Name: 2-[3-(4-bromophenyl)-3-oxopropyl]heptanal Traditional Name: 2-[3-(4-bromophenyl)-3-keto-propyl]enanthaldehyde Formula: C16H21BrO2 MolecularWeight: 325.24074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrO2/c1-2-3-4-5-13(12-18)6-11-16(19)14-7-9-15(17)10-8-14/h7-10,12-13H,2-6,11H2,1H3