2-[5-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[5-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-1-morpholino-ethanone CAS Name: 2-[5-(1-azepan-1-iumylmethyl)-1-tetrazolyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-1-morpholino-ethanone Formula: C14H25N6O2+ MolecularWeight: 309.3873

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=NN=NN2CC(=O)N3CCOCC3

Isomeric SMILES

C1CCC[NH+](CC1)CC2=NN=NN2CC(=O)N3CCOCC3

InChI

InChI=1S/C14H24N6O2/c21-14(19-7-9-22-10-8-19)12-20-13(15-16-17-20)11-18-5-3-1-2-4-6-18/h1-12H2/p+1