dimethyl-[1-(4-methyl-2-oxidanyl-2-phenyl-pentanoyl)piperidin-4-yl]-phenethyl-azanium

Systemtic Name: dimethyl-[1-(4-methyl-2-oxidanyl-2-phenyl-pentanoyl)piperidin-4-yl]-phenethyl-azanium Openeye Name: [1-(2-hydroxy-4-methyl-2-phenyl-pentanoyl)-4-piperidyl]-dimethyl-phenethyl-ammonium CAS Name: [1-(2-hydroxy-4-methyl-1-oxo-2-phenylpentyl)-4-piperidinyl]-dimethyl-phenethylammonium IUPAC Name: [1-(2-hydroxy-4-methyl-2-phenylpentanoyl)piperidin-4-yl]-dimethyl-phenethylazanium Traditional Name: [1-(2-hydroxy-4-methyl-2-phenyl-pentanoyl)-4-piperidyl]-dimethyl-phenethyl-ammonium Formula: C27H39N2O2+ MolecularWeight: 423.61076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)(C(=O)N2CCC(CC2)[N+](C)(C)CCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)(C(=O)N2CCC(CC2)[N+](C)(C)CCC3=CC=CC=C3)O

InChI

InChI=1S/C27H39N2O2/c1-22(2)21-27(31,24-13-9-6-10-14-24)26(30)28-18-15-25(16-19-28)29(3,4)20-17-23-11-7-5-8-12-23/h5-14,22,25,31H,15-21H2,1-4H3/q+1