6-(4-bromophenyl)-3-pentyl-oxan-2-one

Systemtic Name: 6-(4-bromophenyl)-3-pentyl-oxan-2-one Openeye Name: 6-(4-bromophenyl)-3-pentyl-tetrahydropyran-2-one CAS Name: 6-(4-bromophenyl)-3-pentyl-2-oxanone IUPAC Name: 6-(4-bromophenyl)-3-pentyloxan-2-one Traditional Name: 3-amyl-6-(4-bromophenyl)tetrahydropyran-2-one Formula: C16H21BrO2 MolecularWeight: 325.24074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(OC1=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCC1CCC(OC1=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H21BrO2/c1-2-3-4-5-13-8-11-15(19-16(13)18)12-6-9-14(17)10-7-12/h6-7,9-10,13,15H,2-5,8,11H2,1H3