2-(2,2-dimethylpyrrolidin-1-yl)ethyl 5-methyl-2-oxidanyl-2-phenyl-hexanoate hydrochloride

Systemtic Name: 2-(2,2-dimethylpyrrolidin-1-yl)ethyl 5-methyl-2-oxidanyl-2-phenyl-hexanoate hydrochloride Openeye Name: 2-(2,2-dimethylpyrrolidin-1-yl)ethyl 2-hydroxy-5-methyl-2-phenyl-hexanoate hydrochloride CAS Name: 2-hydroxy-5-methyl-2-phenylhexanoic acid 2-(2,2-dimethyl-1-pyrrolidinyl)ethyl ester hydrochloride IUPAC Name: 2-(2,2-dimethylpyrrolidin-1-yl)ethyl 2-hydroxy-5-methyl-2-phenylhexanoate hydrochloride Traditional Name: 2-hydroxy-5-methyl-2-phenyl-hexanoic acid 2-(2,2-dimethylpyrrolidino)ethyl ester hydrochloride Formula: C21H34ClNO3 MolecularWeight: 383.95256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C1=CC=CC=C1)(C(=O)OCCN2CCCC2(C)C)O.Cl

Isomeric SMILES

CC(C)CCC(C1=CC=CC=C1)(C(=O)OCCN2CCCC2(C)C)O.Cl

InChI

InChI=1S/C21H33NO3.ClH/c1-17(2)11-13-21(24,18-9-6-5-7-10-18)19(23)25-16-15-22-14-8-12-20(22,3)4;/h5-7,9-10,17,24H,8,11-16H2,1-4H3;1H