ethyl 2-ethyl-5-methyl-6-(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate

Systemtic Name: ethyl 2-ethyl-5-methyl-6-(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate Openeye Name: ethyl 6-benzyl-2-ethyl-5-methyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate CAS Name: 2-ethyl-5-methyl-6-(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid ethyl ester IUPAC Name: ethyl 6-benzyl-2-ethyl-5-methyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylate Traditional Name: 6-benzyl-2-ethyl-5-methyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid ethyl ester Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2C(CC1C(N2C)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC2C(CC1C(N2C)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C20H27NO2/c1-4-15-12-19-17(20(22)23-5-2)13-16(15)18(21(19)3)11-14-9-7-6-8-10-14/h6-10,12,16-19H,4-5,11,13H2,1-3H3