tert-butyl 3-(2-ethoxycarbonylphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: tert-butyl 3-(2-ethoxycarbonylphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: tert-butyl 3-(2-ethoxycarbonylphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-(2-ethoxycarbonylphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-ethoxycarbonylphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-(2-carbethoxyphenyl)-8-azabicyclo[3.2.1]octane-8-carboxylic acid tert-butyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1C2CC3CCC(C2)N3C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1C2CC3CCC(C2)N3C(=O)OC(C)(C)C

InChI

InChI=1S/C21H29NO4/c1-5-25-19(23)18-9-7-6-8-17(18)14-12-15-10-11-16(13-14)22(15)20(24)26-21(2,3)4/h6-9,14-16H,5,10-13H2,1-4H3