1-azabicyclo[2.2.2]octan-3-yl 3-oxidanylidene-3-phenyl-propanoate chloride

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 3-oxidanylidene-3-phenyl-propanoate chloride Openeye Name: quinuclidin-3-yl 3-oxo-3-phenyl-propanoate chloride CAS Name: 3-oxo-3-phenylpropanoic acid 1-azabicyclo[2.2.2]octan-3-yl ester chloride IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 3-oxo-3-phenylpropanoate chloride Traditional Name: 3-keto-3-phenyl-propionic acid quinuclidin-3-yl ester chloride Formula: C16H19ClNO3- MolecularWeight: 308.77996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)OC(=O)CC(=O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CN2CCC1C(C2)OC(=O)CC(=O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H19NO3.ClH/c18-14(12-4-2-1-3-5-12)10-16(19)20-15-11-17-8-6-13(15)7-9-17;/h1-5,13,15H,6-11H2;1H/p-1