[1-(2,2-dimethylpropanoyl)-4-oxidanyl-piperidin-4-yl]methyl-(phenylmethyl)azanium

Systemtic Name: [1-(2,2-dimethylpropanoyl)-4-oxidanyl-piperidin-4-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[1-(2,2-dimethylpropanoyl)-4-hydroxy-4-piperidyl]methyl]ammonium CAS Name: [1-(2,2-dimethyl-1-oxopropyl)-4-hydroxy-4-piperidinyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[1-(2,2-dimethylpropanoyl)-4-hydroxypiperidin-4-yl]methyl]azanium Traditional Name: benzyl-[(4-hydroxy-1-pivaloyl-4-piperidyl)methyl]ammonium Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)(C[NH2+]CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)(C[NH2+]CC2=CC=CC=C2)O

InChI

InChI=1S/C18H28N2O2/c1-17(2,3)16(21)20-11-9-18(22,10-12-20)14-19-13-15-7-5-4-6-8-15/h4-8,19,22H,9-14H2,1-3H3/p+1