4-[(5S,7R)-3-chloranyl-1-adamantyl]-N,N-dimethyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-amine

Systemtic Name: 4-[(5S,7R)-3-chloranyl-1-adamantyl]-N,N-dimethyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-amine Openeye Name: 4-[(5S,7R)-3-chloro-1-adamantyl]-N,N-dimethyl-2-oxido-1,2,5-oxadiazol-2-ium-3-amine CAS Name: 4-[(5S,7R)-3-chloro-1-adamantyl]-N,N-dimethyl-2-oxido-1,2,5-oxadiazol-2-ium-3-amine IUPAC Name: 4-[(5S,7R)-3-chloro-1-adamantyl]-N,N-dimethyl-2-oxido-1,2,5-oxadiazol-2-ium-3-amine Traditional Name: [4-[(5S,7R)-3-chloro-1-adamantyl]-2-oxido-furazan-2-ium-3-yl]-dimethyl-amine Formula: C14H20ClN3O2 MolecularWeight: 297.7805

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=[N+](ON=C1C23CC4CC(C2)CC(C4)(C3)Cl)[O-]

Isomeric SMILES

CN(C)C1=[N+](ON=C1C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl)[O-]

InChI

InChI=1S/C14H20ClN3O2/c1-17(2)12-11(16-20-18(12)19)13-4-9-3-10(5-13)7-14(15,6-9)8-13/h9-10H,3-8H2,1-2H3/t9-,10+,13?,14?