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

Systemtic Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate; ethanedioic acid Openeye Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetate; oxalic acid CAS Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetic acid 3-azabicyclo[3.3.1]nonan-9-yl ester; oxalic acid IUPAC Name: 3-azabicyclo[3.3.1]nonan-9-yl (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate; oxalic acid Traditional Name: (2R)-2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid 3-azabicyclo[3.3.1]nonan-9-yl ester; oxalic acid Formula: C23H31NO7 MolecularWeight: 433.49474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO3.C2H2O4/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;3-1(4)2(5)6/h1-3,9-10,15-16,18-19,22,24H,4-8,11-14H2;(H,3,4)(H,5,6)/t15?,16?,19?,21-;/m0./s1