1-piperazin-1-yl-3-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propan-1-one

Systemtic Name: 1-piperazin-1-yl-3-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propan-1-one Openeye Name: 1-piperazin-1-yl-3-[4-(2-pyridyl)piperazin-1-ium-1-yl]propan-1-one CAS Name: 1-(1-piperazinyl)-3-[4-(2-pyridinyl)-1-piperazin-1-iumyl]-1-propanone IUPAC Name: 1-piperazin-1-yl-3-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propan-1-one Traditional Name: 1-piperazino-3-[4-(2-pyridyl)piperazin-1-ium-1-yl]propan-1-one Formula: C16H26N5O+ MolecularWeight: 304.41054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CC[NH+]2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1)C(=O)CC[NH+]2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C16H25N5O/c22-16(21-9-6-17-7-10-21)4-8-19-11-13-20(14-12-19)15-3-1-2-5-18-15/h1-3,5,17H,4,6-14H2/p+1