(1,1-dimethylpiperidin-1-ium-4-yl) 2-(4-methylpiperidin-1-yl)-2-phenyl-propanoate

Systemtic Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-(4-methylpiperidin-1-yl)-2-phenyl-propanoate Openeye Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-(4-methyl-1-piperidyl)-2-phenyl-propanoate CAS Name: 2-(4-methyl-1-piperidinyl)-2-phenylpropanoic acid (1,1-dimethyl-4-piperidin-1-iumyl) ester IUPAC Name: (1,1-dimethylpiperidin-1-ium-4-yl) 2-(4-methylpiperidin-1-yl)-2-phenylpropanoate Traditional Name: 2-(4-methylpiperidino)-2-phenyl-propionic acid (1,1-dimethylpiperidin-1-ium-4-yl) ester Formula: C22H35N2O2+ MolecularWeight: 359.5255

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(C)(C2=CC=CC=C2)C(=O)OC3CC[N+](CC3)(C)C

Isomeric SMILES

CC1CCN(CC1)C(C)(C2=CC=CC=C2)C(=O)OC3CC[N+](CC3)(C)C

InChI

InChI=1S/C22H35N2O2/c1-18-10-14-23(15-11-18)22(2,19-8-6-5-7-9-19)21(25)26-20-12-16-24(3,4)17-13-20/h5-9,18,20H,10-17H2,1-4H3/q+1