methyl 8-(3-iodanylpropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 8-(3-iodanylpropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 3-(4-iodophenyl)-8-(3-iodopropyl)-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(4-iodophenyl)-8-(3-iodopropyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-iodophenyl)-8-(3-iodopropyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(4-iodophenyl)-8-(3-iodopropyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C18H23I2NO2 MolecularWeight: 539.18966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2CCC(N2CCCI)CC1C3=CC=C(C=C3)I

Isomeric SMILES

COC(=O)C1C2CCC(N2CCCI)CC1C3=CC=C(C=C3)I

InChI

InChI=1S/C18H23I2NO2/c1-23-18(22)17-15(12-3-5-13(20)6-4-12)11-14-7-8-16(17)21(14)10-2-9-19/h3-6,14-17H,2,7-11H2,1H3