[(7S)-7-oxidanyl-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate chloride

Systemtic Name: [(7S)-7-oxidanyl-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl 2-(1-hydroxyethyl)-3-methyl-2-oxidanyl-butanoate chloride Openeye Name: [(7S)-7-hydroxy-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butanoate chloride CAS Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoic acid [(7S)-7-hydroxy-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl ester chloride IUPAC Name: [(7S)-7-hydroxy-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate chloride Traditional Name: 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-butyric acid [(7S)-7-hydroxy-3,4,5,6,7,8-hexahydropyrrolizin-4-ium-1-yl]methyl ester chloride Formula: C15H26ClNO5 MolecularWeight: 335.82364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)O)(C(=O)OCC1=CC[NH+]2C1C(CC2)O)O.[Cl-]

Isomeric SMILES

CC(C)C(C(C)O)(C(=O)OCC1=CC[NH+]2C1[C@H](CC2)O)O.[Cl-]

InChI

InChI=1S/C15H25NO5.ClH/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16;/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3;1H/t10?,12-,13?,15?;/m0./s1