4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)butan-2-one perchlorate

Systemtic Name: 4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)butan-2-one perchlorate Openeye Name: 4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)butan-2-one perchlorate CAS Name: 4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)-2-butanone perchlorate IUPAC Name: 4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)butan-2-one perchlorate Traditional Name: 4-(3-azoniabicyclo[3.3.1]non-3-en-3-yl)butan-2-one perchlorate Formula: C12H20ClNO5 MolecularWeight: 293.7439

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC[N+]1=CC2CCCC(C2)C1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=O)CC[N+]1=CC2CCCC(C2)C1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H20NO.ClHO4/c1-10(14)5-6-13-8-11-3-2-4-12(7-11)9-13;2-1(3,4)5/h8,11-12H,2-7,9H2,1H3;(H,2,3,4,5)/q+1;/p-1