1-(5-methyl-2-propan-2-yl-phenoxy)-3-(1,2,6-trimethylpiperidin-1-ium-1-yl)propan-2-ol

Systemtic Name: 1-(5-methyl-2-propan-2-yl-phenoxy)-3-(1,2,6-trimethylpiperidin-1-ium-1-yl)propan-2-ol Openeye Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-(1,2,6-trimethylpiperidin-1-ium-1-yl)propan-2-ol CAS Name: 1-(5-methyl-2-propan-2-ylphenoxy)-3-(1,2,6-trimethyl-1-piperidin-1-iumyl)-2-propanol IUPAC Name: 1-(5-methyl-2-propan-2-ylphenoxy)-3-(1,2,6-trimethylpiperidin-1-ium-1-yl)propan-2-ol Traditional Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-(1,2,6-trimethylpiperidin-1-ium-1-yl)propan-2-ol Formula: C21H36NO2+ MolecularWeight: 334.51604

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([N+]1(C)CC(COC2=C(C=CC(=C2)C)C(C)C)O)C

Isomeric SMILES

CC1CCCC([N+]1(C)CC(COC2=C(C=CC(=C2)C)C(C)C)O)C

InChI

InChI=1S/C21H36NO2/c1-15(2)20-11-10-16(3)12-21(20)24-14-19(23)13-22(6)17(4)8-7-9-18(22)5/h10-12,15,17-19,23H,7-9,13-14H2,1-6H3/q+1