2-(phenylsulfonyloxy)ethyl 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: 2-(phenylsulfonyloxy)ethyl 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: 2-(benzenesulfonyloxy)ethyl 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid 2-(benzenesulfonyloxy)ethyl ester IUPAC Name: 2-(benzenesulfonyloxy)ethyl 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid 2-besyloxyethyl ester Formula: C23H26INO5S MolecularWeight: 555.42571

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)C3=CC=C(C=C3)I)C(=O)OCCOS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C2CCC1C(C(C2)C3=CC=C(C=C3)I)C(=O)OCCOS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26INO5S/c1-25-18-11-12-21(25)22(20(15-18)16-7-9-17(24)10-8-16)23(26)29-13-14-30-31(27,28)19-5-3-2-4-6-19/h2-10,18,20-22H,11-15H2,1H3