[(4S)-3-azabicyclo[2.2.1]heptan-7-yl] 2-cyclopentyl-2-(2-methylphenyl)-2-oxidanyl-ethanoate

Systemtic Name: [(4S)-3-azabicyclo[2.2.1]heptan-7-yl] 2-cyclopentyl-2-(2-methylphenyl)-2-oxidanyl-ethanoate Openeye Name: [(4S)-3-azabicyclo[2.2.1]heptan-7-yl] 2-cyclopentyl-2-hydroxy-2-(o-tolyl)acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-(2-methylphenyl)acetic acid [(4S)-3-azabicyclo[2.2.1]heptan-7-yl] ester IUPAC Name: [(4S)-3-azabicyclo[2.2.1]heptan-7-yl] 2-cyclopentyl-2-hydroxy-2-(2-methylphenyl)acetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-(o-tolyl)acetic acid [(4S)-3-azabicyclo[2.2.1]heptan-7-yl] ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2CCCC2)(C(=O)OC3C4CCC3NC4)O

Isomeric SMILES

CC1=CC=CC=C1C(C2CCCC2)(C(=O)OC3[C@@H]4CCC3CN4)O

InChI

InChI=1S/C20H27NO3/c1-13-6-2-5-9-16(13)20(23,15-7-3-4-8-15)19(22)24-18-14-10-11-17(18)21-12-14/h2,5-6,9,14-15,17-18,21,23H,3-4,7-8,10-12H2,1H3/t14?,17-,18?,20?/m0/s1