1-methyl-4-propan-2-yl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid

Systemtic Name: 1-methyl-4-propan-2-yl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid Openeye Name: 4-isopropyl-1-methyl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid CAS Name: 1-methyl-4-propan-2-yl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid IUPAC Name: 1-methyl-4-propan-2-yl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid Traditional Name: 4-isopropyl-1-methyl-3-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C12CCC(C=C1)(C(N2)C(=O)O)C

Isomeric SMILES

CC(C)C12CCC(C=C1)(C(N2)C(=O)O)C

InChI

InChI=1S/C12H19NO2/c1-8(2)12-6-4-11(3,5-7-12)9(13-12)10(14)15/h4,6,8-9,13H,5,7H2,1-3H3,(H,14,15)