1-(3-piperazin-4-ium-1-ylpropyl)azepan-1-ium

Systemtic Name: 1-(3-piperazin-4-ium-1-ylpropyl)azepan-1-ium Openeye Name: 1-(3-piperazin-4-ium-1-ylpropyl)azepan-1-ium CAS Name: 1-[3-(1-piperazin-4-iumyl)propyl]azepan-1-ium IUPAC Name: 1-(3-piperazin-4-ium-1-ylpropyl)azepan-1-ium Traditional Name: 1-(3-piperazin-4-ium-1-ylpropyl)azepan-1-ium Formula: C13H29N3+2 MolecularWeight: 227.38946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCN2CC[NH2+]CC2

Isomeric SMILES

C1CCC[NH+](CC1)CCCN2CC[NH2+]CC2

InChI

InChI=1S/C13H27N3/c1-2-4-9-15(8-3-1)10-5-11-16-12-6-14-7-13-16/h14H,1-13H2/p+2