(1-methyl-2,5-dihydro-1H-pyrrol-1-ium-3-yl)methyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate chloride

Systemtic Name: (1-methyl-2,5-dihydro-1H-pyrrol-1-ium-3-yl)methyl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate chloride Openeye Name: (1-methyl-2,5-dihydro-1H-pyrrol-1-ium-3-yl)methyl 2-cyclopentyl-2-hydroxy-2-phenyl-acetate chloride CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid (1-methyl-2,5-dihydro-1H-pyrrol-1-ium-3-yl)methyl ester chloride IUPAC Name: (1-methyl-2,5-dihydro-1H-pyrrol-1-ium-3-yl)methyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid (1-methyl-3-pyrrolin-1-ium-3-yl)methyl ester chloride Formula: C19H26ClNO3 MolecularWeight: 351.86764

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC=C(C1)COC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

C[NH+]1CC=C(C1)COC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C19H25NO3.ClH/c1-20-12-11-15(13-20)14-23-18(21)19(22,17-9-5-6-10-17)16-7-3-2-4-8-16;/h2-4,7-8,11,17,22H,5-6,9-10,12-14H2,1H3;1H