methyl 2-[1-(4-iodophenyl)carbonyl-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxy-propanoate

Systemtic Name: methyl 2-[1-(4-iodophenyl)carbonyl-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxy-propanoate Openeye Name: methyl 2-[1-(4-iodobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxy-propanoate CAS Name: 2-[1-[(4-iodophenyl)-oxomethyl]-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxypropanoic acid methyl ester IUPAC Name: methyl 2-[1-(4-iodobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxypropanoate Traditional Name: 2-[1-(4-iodobenzoyl)-3,6-dihydro-2H-pyridin-4-yl]-2-phenoxy-propionic acid methyl ester Formula: C22H22INO4 MolecularWeight: 491.31885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CCN(CC1)C(=O)C2=CC=C(C=C2)I)(C(=O)OC)OC3=CC=CC=C3

Isomeric SMILES

CC(C1=CCN(CC1)C(=O)C2=CC=C(C=C2)I)(C(=O)OC)OC3=CC=CC=C3

InChI

InChI=1S/C22H22INO4/c1-22(21(26)27-2,28-19-6-4-3-5-7-19)17-12-14-24(15-13-17)20(25)16-8-10-18(23)11-9-16/h3-12H,13-15H2,1-2H3