methyl 3-[(2S,5S)-4-iodanyl-2-methyl-6-oxidanylidene-1-(phenylmethyl)-2,5-dihydropyridin-5-yl]propanoate

Systemtic Name: methyl 3-[(2S,5S)-4-iodanyl-2-methyl-6-oxidanylidene-1-(phenylmethyl)-2,5-dihydropyridin-5-yl]propanoate Openeye Name: methyl 3-[(2S,5S)-1-benzyl-4-iodo-2-methyl-6-oxo-2,5-dihydropyridin-5-yl]propanoate CAS Name: 3-[(2S,5S)-4-iodo-2-methyl-6-oxo-1-(phenylmethyl)-2,5-dihydropyridin-5-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[(2S,5S)-1-benzyl-4-iodo-2-methyl-6-oxo-2,5-dihydropyridin-5-yl]propanoate Traditional Name: 3-[(2S,5S)-1-benzyl-4-iodo-6-keto-2-methyl-2,5-dihydropyridin-5-yl]propionic acid methyl ester Formula: C17H20INO3 MolecularWeight: 413.25007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(C(=O)N1CC2=CC=CC=C2)CCC(=O)OC)I

Isomeric SMILES

C[C@H]1C=C([C@H](C(=O)N1CC2=CC=CC=C2)CCC(=O)OC)I

InChI

InChI=1S/C17H20INO3/c1-12-10-15(18)14(8-9-16(20)22-2)17(21)19(12)11-13-6-4-3-5-7-13/h3-7,10,12,14H,8-9,11H2,1-2H3/t12-,14+/m0/s1