1-(azepan-1-yl)-2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-ium-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazin-1-ium-1-yl]ethanone Formula: C20H37N4O2+ MolecularWeight: 365.53338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)CC(=O)N3CCCCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C20H36N4O2/c25-19(23-9-5-1-2-6-10-23)17-21-13-15-22(16-14-21)18-20(26)24-11-7-3-4-8-12-24/h1-18H2/p+1