(3-bromophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(4-pyridylmethyl)piperazino]methanone Formula: C17H18BrN3O MolecularWeight: 360.24832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O/c18-16-3-1-2-15(12-16)17(22)21-10-8-20(9-11-21)13-14-4-6-19-7-5-14/h1-7,12H,8-11,13H2