[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone

Systemtic Name: [4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone Openeye Name: (3-benzyloxyphenyl)-[4-(5-bromo-2-pyridyl)piperazin-1-yl]methanone CAS Name: [4-(5-bromo-2-pyridinyl)-1-piperazinyl]-(3-phenylmethoxyphenyl)methanone IUPAC Name: [4-(5-bromopyridin-2-yl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone Traditional Name: (3-benzoxyphenyl)-[4-(5-bromo-2-pyridyl)piperazino]methanone Formula: C23H22BrN3O2 MolecularWeight: 452.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H22BrN3O2/c24-20-9-10-22(25-16-20)26-11-13-27(14-12-26)23(28)19-7-4-8-21(15-19)29-17-18-5-2-1-3-6-18/h1-10,15-16H,11-14,17H2