5-azoniaspiro[4.4]nonan-8-yl 2-oxidanyl-2-(1H-pyrrol-3-yl)propanoate chloride

Systemtic Name: 5-azoniaspiro[4.4]nonan-8-yl 2-oxidanyl-2-(1H-pyrrol-3-yl)propanoate chloride Openeye Name: 5-azoniaspiro[4.4]nonan-8-yl 2-hydroxy-2-(1H-pyrrol-3-yl)propanoate chloride CAS Name: 2-hydroxy-2-(1H-pyrrol-3-yl)propanoic acid 5-azoniaspiro[4.4]nonan-8-yl ester chloride IUPAC Name: 5-azoniaspiro[4.4]nonan-8-yl 2-hydroxy-2-(1H-pyrrol-3-yl)propanoate chloride Traditional Name: 2-hydroxy-2-(1H-pyrrol-3-yl)propionic acid 5-azoniaspiro[4.4]nonan-8-yl ester chloride Formula: C15H23ClN2O3 MolecularWeight: 314.80772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC=C1)(C(=O)OC2CC[N+]3(C2)CCCC3)O.[Cl-]

Isomeric SMILES

CC(C1=CNC=C1)(C(=O)OC2CC[N+]3(C2)CCCC3)O.[Cl-]

InChI

InChI=1S/C15H23N2O3.ClH/c1-15(19,12-4-6-16-10-12)14(18)20-13-5-9-17(11-13)7-2-3-8-17;/h4,6,10,13,16,19H,2-3,5,7-9,11H2,1H3;1H/q+1;/p-1