(phenylmethyl) 4-(5-bromanylpyridin-2-yl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(5-bromanylpyridin-2-yl)piperazine-1-carboxylate Openeye Name: benzyl 4-(5-bromo-2-pyridyl)piperazine-1-carboxylate CAS Name: 4-(5-bromo-2-pyridinyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(5-bromopyridin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(5-bromo-2-pyridyl)piperazine-1-carboxylic acid benzyl ester Formula: C17H18BrN3O2 MolecularWeight: 376.24772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H18BrN3O2/c18-15-6-7-16(19-12-15)20-8-10-21(11-9-20)17(22)23-13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2