2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid 2-(1,2,2-trimethyl-1-pyrrolidin-1-iumyl)ethyl ester IUPAC Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl ester Formula: C22H34NO3+ MolecularWeight: 360.51026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC[N+]1(C)CCOC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C

Isomeric SMILES

CC1(CCC[N+]1(C)CCOC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C

InChI

InChI=1S/C22H34NO3/c1-21(2)14-9-15-23(21,3)16-17-26-20(24)22(25,19-12-7-8-13-19)18-10-5-4-6-11-18/h4-6,10-11,19,25H,7-9,12-17H2,1-3H3/q+1