ethyl 1-[3-(phenylcarbonyloxy)propyl]piperidin-1-ium-3-carboxylate chloride

Systemtic Name: ethyl 1-[3-(phenylcarbonyloxy)propyl]piperidin-1-ium-3-carboxylate chloride Openeye Name: ethyl 1-(3-benzoyloxypropyl)piperidin-1-ium-3-carboxylate chloride CAS Name: 1-(3-benzoyloxypropyl)-3-piperidin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 1-(3-benzoyloxypropyl)piperidin-1-ium-3-carboxylate chloride Traditional Name: 1-(3-benzoyloxypropyl)piperidin-1-ium-3-carboxylic acid ethyl ester chloride Formula: C18H26ClNO4 MolecularWeight: 355.85634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CCCOC(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCOC(=O)C1CCC[NH+](C1)CCCOC(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C18H25NO4.ClH/c1-2-22-18(21)16-10-6-11-19(14-16)12-7-13-23-17(20)15-8-4-3-5-9-15;/h3-5,8-9,16H,2,6-7,10-14H2,1H3;1H