methyl 3-(3-iodanyl-4-propan-2-yl-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 3-(3-iodanyl-4-propan-2-yl-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 3-(3-iodo-4-isopropyl-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(3-iodo-4-propan-2-ylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(3-iodo-4-propan-2-ylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(3-iodo-4-isopropyl-phenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C19H26INO2 MolecularWeight: 427.31971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C2CC3CCC(C2C(=O)OC)N3C)I

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)C2CC3CCC(C2C(=O)OC)N3C)I

InChI

InChI=1S/C19H26INO2/c1-11(2)14-7-5-12(9-16(14)20)15-10-13-6-8-17(21(13)3)18(15)19(22)23-4/h5,7,9,11,13,15,17-18H,6,8,10H2,1-4H3