3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrobromide

Systemtic Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrobromide Openeye Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetate hydrobromide CAS Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetic acid 3-azabicyclo[3.3.1]nonan-9-yl ester hydrobromide IUPAC Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate hydrobromide Traditional Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid 3-azabicyclo[3.3.1]nonan-9-yl ester hydrobromide Formula: C21H30BrNO3 MolecularWeight: 424.3718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3C4CCCC3CNC4)O.Br

Isomeric SMILES

C1CCC(C1)[C@@](C2=CC=CC=C2)(C(=O)OC3C4CCCC3CNC4)O.Br

InChI

InChI=1S/C21H29NO3.BrH/c23-20(25-19-15-7-6-8-16(19)14-22-13-15)21(24,18-11-4-5-12-18)17-9-2-1-3-10-17;/h1-3,9-10,15-16,18-19,22,24H,4-8,11-14H2;1H/t15?,16?,19?,21-;/m0./s1