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

Systemtic Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-[(4-bromophenyl)methyl]-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-[(4-bromophenyl)methyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-(4-bromobenzyl)piperazino]cyclohepta-2,4,6-trien-1-one Formula: C18H19BrN2O MolecularWeight: 359.26026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Br)C3=CC=CC=CC3=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Br)C3=CC=CC=CC3=O

InChI

InChI=1S/C18H19BrN2O/c19-16-8-6-15(7-9-16)14-20-10-12-21(13-11-20)17-4-2-1-3-5-18(17)22/h1-9H,10-14H2