4-[(2-chlorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate

Systemtic Name: 4-[(2-chlorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate Openeye Name: 4-[(2-chlorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate CAS Name: 4-[(2-chlorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate IUPAC Name: 4-[(2-chlorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate Traditional Name: 4-(2-chlorobenzyl)-1-aza-4-azoniabicyclo[2.2.2]octane perchlorate Formula: C13H18Cl2N2O4 MolecularWeight: 337.19902

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN1CC2)CC3=CC=CC=C3Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1C[N+]2(CCN1CC2)CC3=CC=CC=C3Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H18ClN2.ClHO4/c14-13-4-2-1-3-12(13)11-16-8-5-15(6-9-16)7-10-16;2-1(3,4)5/h1-4H,5-11H2;(H,2,3,4,5)/q+1;/p-1