5-bromanyl-1-[(E)-3-phenylprop-2-enyl]azepan-4-one hydrobromide

Systemtic Name: 5-bromanyl-1-[(E)-3-phenylprop-2-enyl]azepan-4-one hydrobromide Openeye Name: 5-bromo-1-[(E)-cinnamyl]azepan-4-one hydrobromide CAS Name: 5-bromo-1-[(E)-3-phenylprop-2-enyl]-4-azepanone hydrobromide IUPAC Name: 5-bromo-1-[(E)-3-phenylprop-2-enyl]azepan-4-one hydrobromide Traditional Name: 5-bromo-1-[(E)-cinnamyl]azepan-4-one hydrobromide Formula: C15H19Br2NO MolecularWeight: 389.12546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC(=O)C1Br)CC=CC2=CC=CC=C2.Br

Isomeric SMILES

C1CN(CCC(=O)C1Br)C/C=C/C2=CC=CC=C2.Br

InChI

InChI=1S/C15H18BrNO.BrH/c16-14-8-11-17(12-9-15(14)18)10-4-7-13-5-2-1-3-6-13;/h1-7,14H,8-12H2;1H/b7-4+;