(2,2-dimethyl-3-oxidanyl-propyl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-azanium

Systemtic Name: (2,2-dimethyl-3-oxidanyl-propyl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-azanium Openeye Name: (3-hydroxy-2,2-dimethyl-propyl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-ammonium CAS Name: (3-hydroxy-2,2-dimethylpropyl)-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-phenethylammonium IUPAC Name: (3-hydroxy-2,2-dimethylpropyl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethylazanium Traditional Name: (3-hydroxy-2,2-dimethyl-propyl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-ammonium Formula: C20H36N2O+2 MolecularWeight: 320.51264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+](CCC1=CC=CC=C1)CC2CCC[NH+](C2)C)CO

Isomeric SMILES

CC(C)(C[NH+](CCC1=CC=CC=C1)C[C@@H]2CCC[NH+](C2)C)CO

InChI

InChI=1S/C20H34N2O/c1-20(2,17-23)16-22(13-11-18-8-5-4-6-9-18)15-19-10-7-12-21(3)14-19/h4-6,8-9,19,23H,7,10-17H2,1-3H3/p+2/t19-/m1/s1