(4-propan-2-ylpiperazin-4-ium-1-yl)-pyridin-4-yl-methanone

Systemtic Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-pyridin-4-yl-methanone Openeye Name: (4-isopropylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone CAS Name: (4-propan-2-yl-1-piperazin-4-iumyl)-pyridin-4-ylmethanone IUPAC Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-pyridin-4-ylmethanone Traditional Name: (4-isopropylpiperazin-4-ium-1-yl)-(4-pyridyl)methanone Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC=NC=C2

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC=NC=C2

InChI

InChI=1S/C13H19N3O/c1-11(2)15-7-9-16(10-8-15)13(17)12-3-5-14-6-4-12/h3-6,11H,7-10H2,1-2H3/p+1