(3-methyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: (3-methyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: (3-methyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid (3-methyl-3-azabicyclo[3.2.1]octan-8-yl) ester IUPAC Name: (3-methyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid (3-methyl-3-azabicyclo[3.2.1]octan-8-yl) ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2CCC(C1)C2OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CN1CC2CCC(C1)C2OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C21H29NO3/c1-22-13-15-11-12-16(14-22)19(15)25-20(23)21(24,18-9-5-6-10-18)17-7-3-2-4-8-17/h2-4,7-8,15-16,18-19,24H,5-6,9-14H2,1H3