1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-(2-methylphenyl)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-(2-methylphenyl)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: 1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-hydroxy-2-(o-tolyl)-2-phenyl-acetate CAS Name: 2-hydroxy-2-(2-methylphenyl)-2-phenylacetic acid 1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl ester IUPAC Name: 1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-hydroxy-2-(2-methylphenyl)-2-phenylacetate Traditional Name: 2-hydroxy-2-(o-tolyl)-2-phenyl-acetic acid 1-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl ester Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)(C(=O)OC(C)N3C4CCCC3CCC4)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)(C(=O)OC(C)N3C4CCCC3CCC4)O

InChI

InChI=1S/C25H31NO3/c1-18-10-6-7-17-23(18)25(28,20-11-4-3-5-12-20)24(27)29-19(2)26-21-13-8-14-22(26)16-9-15-21/h3-7,10-12,17,19,21-22,28H,8-9,13-16H2,1-2H3