6-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1,2,3,6-tetrahydroazepin-7-one

Systemtic Name: 6-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1,2,3,6-tetrahydroazepin-7-one Openeye Name: 6-[(3,5-dibromo-4-methoxy-phenyl)methyl]-1,2,3,6-tetrahydroazepin-7-one CAS Name: 6-[(3,5-dibromo-4-methoxyphenyl)methyl]-1,2,3,6-tetrahydroazepin-7-one IUPAC Name: 6-[(3,5-dibromo-4-methoxyphenyl)methyl]-1,2,3,6-tetrahydroazepin-7-one Traditional Name: 6-(3,5-dibromo-4-methoxy-benzyl)-1,2,3,6-tetrahydroazepin-7-one Formula: C14H15Br2NO2 MolecularWeight: 389.0824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)CC2C=CCCNC2=O)Br

Isomeric SMILES

COC1=C(C=C(C=C1Br)CC2C=CCCNC2=O)Br

InChI

InChI=1S/C14H15Br2NO2/c1-19-13-11(15)7-9(8-12(13)16)6-10-4-2-3-5-17-14(10)18/h2,4,7-8,10H,3,5-6H2,1H3,(H,17,18)