2-ethyl-5,6-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid

Systemtic Name: 2-ethyl-5,6-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid Openeye Name: 5,6-dibenzyl-2-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid CAS Name: 2-ethyl-5,6-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid IUPAC Name: 5,6-dibenzyl-2-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid Traditional Name: 5,6-dibenzyl-2-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2C(CC1C(N2CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCC1=CC2C(CC1C(N2CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H27NO2/c1-2-19-14-23-21(24(26)27)15-20(19)22(13-17-9-5-3-6-10-17)25(23)16-18-11-7-4-8-12-18/h3-12,14,20-23H,2,13,15-16H2,1H3,(H,26,27)