[7-oxidanylidene-7-(4-pyridin-1-ium-2-ylpiperazin-1-yl)heptyl]azanium

Systemtic Name: [7-oxidanylidene-7-(4-pyridin-1-ium-2-ylpiperazin-1-yl)heptyl]azanium Openeye Name: [7-oxo-7-(4-pyridin-1-ium-2-ylpiperazin-1-yl)heptyl]ammonium CAS Name: [7-oxo-7-[4-(2-pyridin-1-iumyl)-1-piperazinyl]heptyl]ammonium IUPAC Name: [7-oxo-7-(4-pyridin-1-ium-2-ylpiperazin-1-yl)heptyl]azanium Traditional Name: [7-keto-7-(4-pyridin-1-ium-2-ylpiperazino)heptyl]ammonium Formula: C16H28N4O+2 MolecularWeight: 292.41972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCCCC[NH3+]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCCCC[NH3+]

InChI

InChI=1S/C16H26N4O/c17-9-5-2-1-3-8-16(21)20-13-11-19(12-14-20)15-7-4-6-10-18-15/h4,6-7,10H,1-3,5,8-9,11-14,17H2/p+2