(2-bromanylpyridin-4-yl)-[(3R)-3-methylpiperazin-4-ium-1-yl]methanone

Systemtic Name: (2-bromanylpyridin-4-yl)-[(3R)-3-methylpiperazin-4-ium-1-yl]methanone Openeye Name: (2-bromo-4-pyridyl)-[(3R)-3-methylpiperazin-4-ium-1-yl]methanone CAS Name: (2-bromo-4-pyridinyl)-[(3R)-3-methyl-1-piperazin-4-iumyl]methanone IUPAC Name: (2-bromopyridin-4-yl)-[(3R)-3-methylpiperazin-4-ium-1-yl]methanone Traditional Name: (2-bromo-4-pyridyl)-[(3R)-3-methylpiperazin-4-ium-1-yl]methanone Formula: C11H15BrN3O+ MolecularWeight: 285.1603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH2+]1)C(=O)C2=CC(=NC=C2)Br

Isomeric SMILES

C[C@@H]1CN(CC[NH2+]1)C(=O)C2=CC(=NC=C2)Br

InChI

InChI=1S/C11H14BrN3O/c1-8-7-15(5-4-13-8)11(16)9-2-3-14-10(12)6-9/h2-3,6,8,13H,4-5,7H2,1H3/p+1/t8-/m1/s1