2,2,8,8-tetramethyl-5-pyridin-1-ium-3-yl-nonane-3,7-dione perchlorate

Systemtic Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-3-yl-nonane-3,7-dione perchlorate Openeye Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-3-yl-nonane-3,7-dione perchlorate CAS Name: 2,2,8,8-tetramethyl-5-(3-pyridin-1-iumyl)nonane-3,7-dione perchlorate IUPAC Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-3-ylnonane-3,7-dione perchlorate Traditional Name: 2,2,8,8-tetramethyl-5-pyridin-1-ium-3-yl-nonane-3,7-dione perchlorate Formula: C18H28ClNO6 MolecularWeight: 389.87102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(CC(=O)C(C)(C)C)C1=C[NH+]=CC=C1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)(C)C(=O)CC(CC(=O)C(C)(C)C)C1=C[NH+]=CC=C1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H27NO2.ClHO4/c1-17(2,3)15(20)10-14(11-16(21)18(4,5)6)13-8-7-9-19-12-13;2-1(3,4)5/h7-9,12,14H,10-11H2,1-6H3;(H,2,3,4,5)