(2S,5S)-4-iodanyl-2-methyl-5-(3-oxidanylpropyl)-1-(phenylmethyl)-2,5-dihydropyridin-6-one

Systemtic Name: (2S,5S)-4-iodanyl-2-methyl-5-(3-oxidanylpropyl)-1-(phenylmethyl)-2,5-dihydropyridin-6-one Openeye Name: (2S,5S)-1-benzyl-5-(3-hydroxypropyl)-4-iodo-2-methyl-2,5-dihydropyridin-6-one CAS Name: (2S,5S)-5-(3-hydroxypropyl)-4-iodo-2-methyl-1-(phenylmethyl)-2,5-dihydropyridin-6-one IUPAC Name: (2S,5S)-1-benzyl-5-(3-hydroxypropyl)-4-iodo-2-methyl-2,5-dihydropyridin-6-one Traditional Name: (2S,5S)-1-benzyl-5-(3-hydroxypropyl)-4-iodo-2-methyl-2,5-dihydropyridin-6-one Formula: C16H20INO2 MolecularWeight: 385.23997

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(C(=O)N1CC2=CC=CC=C2)CCCO)I

Isomeric SMILES

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

InChI

InChI=1S/C16H20INO2/c1-12-10-15(17)14(8-5-9-19)16(20)18(12)11-13-6-3-2-4-7-13/h2-4,6-7,10,12,14,19H,5,8-9,11H2,1H3/t12-,14+/m0/s1