1-[4-(3-bromanylpyridin-4-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one

Systemtic Name: 1-[4-(3-bromanylpyridin-4-yl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one Openeye Name: 1-[4-(3-bromo-4-pyridyl)piperazin-1-yl]-3-phenyl-prop-2-yn-1-one CAS Name: 1-[4-(3-bromo-4-pyridinyl)-1-piperazinyl]-3-phenyl-2-propyn-1-one IUPAC Name: 1-[4-(3-bromopyridin-4-yl)piperazin-1-yl]-3-phenylprop-2-yn-1-one Traditional Name: 1-[4-(3-bromo-4-pyridyl)piperazino]-3-phenyl-prop-2-yn-1-one Formula: C18H16BrN3O MolecularWeight: 370.24314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=NC=C2)Br)C(=O)C#CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=NC=C2)Br)C(=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C18H16BrN3O/c19-16-14-20-9-8-17(16)21-10-12-22(13-11-21)18(23)7-6-15-4-2-1-3-5-15/h1-5,8-9,14H,10-13H2