4-(5-bromanyl-2-hexoxy-phenyl)but-3-en-2-one

Systemtic Name: 4-(5-bromanyl-2-hexoxy-phenyl)but-3-en-2-one Openeye Name: 4-(5-bromo-2-hexoxy-phenyl)but-3-en-2-one CAS Name: 4-(5-bromo-2-hexoxyphenyl)-3-buten-2-one IUPAC Name: 4-(5-bromo-2-hexoxyphenyl)but-3-en-2-one Traditional Name: 4-(5-bromo-2-hexoxy-phenyl)but-3-en-2-one Formula: C16H21BrO2 MolecularWeight: 325.24074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C=CC(=O)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C=CC(=O)C

InChI

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