methyl 2-[1-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonylpiperidin-4-yl]-2-phenoxy-propanoate

Systemtic Name: methyl 2-[1-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]carbonylpiperidin-4-yl]-2-phenoxy-propanoate Openeye Name: methyl 2-[1-(4-hydroxy-3,5-diiodo-benzoyl)-4-piperidyl]-2-phenoxy-propanoate CAS Name: 2-[1-[(4-hydroxy-3,5-diiodophenyl)-oxomethyl]-4-piperidinyl]-2-phenoxypropanoic acid methyl ester IUPAC Name: methyl 2-[1-(4-hydroxy-3,5-diiodobenzoyl)piperidin-4-yl]-2-phenoxypropanoate Traditional Name: 2-[1-(4-hydroxy-3,5-diiodo-benzoyl)-4-piperidyl]-2-phenoxy-propionic acid methyl ester Formula: C22H23I2NO5 MolecularWeight: 635.23066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(CC1)C(=O)C2=CC(=C(C(=C2)I)O)I)(C(=O)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C1CCN(CC1)C(=O)C2=CC(=C(C(=C2)I)O)I)(C(=O)OC)OC3=CC=CC=C3

InChI

InChI=1S/C22H23I2NO5/c1-22(21(28)29-2,30-16-6-4-3-5-7-16)15-8-10-25(11-9-15)20(27)14-12-17(23)19(26)18(24)13-14/h3-7,12-13,15,26H,8-11H2,1-2H3