prop-2-enyl 2-tert-butyl-6-iodanyl-5-methyl-4-phenyl-pyridine-3-carboxylate

Systemtic Name: prop-2-enyl 2-tert-butyl-6-iodanyl-5-methyl-4-phenyl-pyridine-3-carboxylate Openeye Name: allyl 2-tert-butyl-6-iodo-5-methyl-4-phenyl-pyridine-3-carboxylate CAS Name: 2-tert-butyl-6-iodo-5-methyl-4-phenyl-3-pyridinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-tert-butyl-6-iodo-5-methyl-4-phenylpyridine-3-carboxylate Traditional Name: 2-tert-butyl-6-iodo-5-methyl-4-phenyl-nicotinic acid allyl ester Formula: C20H22INO2 MolecularWeight: 435.29865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C2=CC=CC=C2)C(=O)OCC=C)C(C)(C)C)I

Isomeric SMILES

CC1=C(N=C(C(=C1C2=CC=CC=C2)C(=O)OCC=C)C(C)(C)C)I

InChI

InChI=1S/C20H22INO2/c1-6-12-24-19(23)16-15(14-10-8-7-9-11-14)13(2)18(21)22-17(16)20(3,4)5/h6-11H,1,12H2,2-5H3