2-ethyl-4,5-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid

Systemtic Name: 2-ethyl-4,5-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid Openeye Name: 4,5-dibenzyl-2-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid CAS Name: 2-ethyl-4,5-bis(phenylmethyl)-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid IUPAC Name: 4,5-dibenzyl-2-ethyl-5-azabicyclo[2.2.2]oct-2-ene-8-carboxylic acid Traditional Name: 4,5-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=CC2(C(CC1CN2CC3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2(C(CC1CN2CC3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4

InChI

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