1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium

Systemtic Name: 1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium Openeye Name: 1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium CAS Name: 1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium IUPAC Name: 1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium Traditional Name: 1-[[2-[2-(4-tert-butylphenyl)ethyl]-1,3-dioxolan-4-yl]methyl]piperidin-1-ium Formula: C21H34NO2+ MolecularWeight: 332.50016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC2OCC(O2)C[NH+]3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC2OCC(O2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H33NO2/c1-21(2,3)18-10-7-17(8-11-18)9-12-20-23-16-19(24-20)15-22-13-5-4-6-14-22/h7-8,10-11,19-20H,4-6,9,12-16H2,1-3H3/p+1