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

Systemtic Name: 6-(4-bromophenyl)-3-propyl-oxan-2-one Openeye Name: 6-(4-bromophenyl)-3-propyl-tetrahydropyran-2-one CAS Name: 6-(4-bromophenyl)-3-propyl-2-oxanone IUPAC Name: 6-(4-bromophenyl)-3-propyloxan-2-one Traditional Name: 6-(4-bromophenyl)-3-propyl-tetrahydropyran-2-one Formula: C14H17BrO2 MolecularWeight: 297.18758

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(OC1=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCC1CCC(OC1=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H17BrO2/c1-2-3-11-6-9-13(17-14(11)16)10-4-7-12(15)8-5-10/h4-5,7-8,11,13H,2-3,6,9H2,1H3