4-(azepan-1-ium-1-yl)-1-piperazin-1-yl-butan-1-one

Systemtic Name: 4-(azepan-1-ium-1-yl)-1-piperazin-1-yl-butan-1-one Openeye Name: 4-(azepan-1-ium-1-yl)-1-piperazin-1-yl-butan-1-one CAS Name: 4-(1-azepan-1-iumyl)-1-(1-piperazinyl)-1-butanone IUPAC Name: 4-(azepan-1-ium-1-yl)-1-piperazin-1-ylbutan-1-one Traditional Name: 4-(azepan-1-ium-1-yl)-1-piperazino-butan-1-one Formula: C14H28N3O+ MolecularWeight: 254.39162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCC(=O)N2CCNCC2

Isomeric SMILES

C1CCC[NH+](CC1)CCCC(=O)N2CCNCC2

InChI

InChI=1S/C14H27N3O/c18-14(17-12-7-15-8-13-17)6-5-11-16-9-3-1-2-4-10-16/h15H,1-13H2/p+1