[4-(piperidin-1-ium-4-ylmethyl)piperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-(piperidin-1-ium-4-ylmethyl)piperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-(piperidin-1-ium-4-ylmethyl)piperazin-1-yl]-(3-pyridyl)methanone CAS Name: [4-(4-piperidin-1-iumylmethyl)-1-piperazinyl]-(3-pyridinyl)methanone IUPAC Name: [4-(piperidin-1-ium-4-ylmethyl)piperazin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-(piperidin-1-ium-4-ylmethyl)piperazino]-(3-pyridyl)methanone Formula: C16H25N4O+ MolecularWeight: 289.3959

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1CN2CCN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1C[NH2+]CCC1CN2CCN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H24N4O/c21-16(15-2-1-5-18-12-15)20-10-8-19(9-11-20)13-14-3-6-17-7-4-14/h1-2,5,12,14,17H,3-4,6-11,13H2/p+1