2-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-[(1R,2R,4S)-norbornan-2-yl]-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-[(1R,2R,4S)-norbornan-2-yl]-1-piperazin-4-ium-1-yl-ethanone Formula: C13H23N2O+ MolecularWeight: 223.33452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2CC(=O)N3CC[NH2+]CC3

Isomeric SMILES

C1C[C@@H]2C[C@H]1C[C@@H]2CC(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C13H22N2O/c16-13(15-5-3-14-4-6-15)9-12-8-10-1-2-11(12)7-10/h10-12,14H,1-9H2/p+1/t10-,11+,12+/m0/s1