2-bromanyl-7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-bromanyl-7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-bromo-7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-bromo-7-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-bromo-7-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-bromo-7-[4-(4-chlorobenzyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C18H18BrClN2O MolecularWeight: 393.70532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=CC=CC=C(C3=O)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=CC=CC=C(C3=O)Br

InChI

InChI=1S/C18H18BrClN2O/c19-16-3-1-2-4-17(18(16)23)22-11-9-21(10-12-22)13-14-5-7-15(20)8-6-14/h1-8H,9-13H2