2-(2-iodanylpyridin-3-yl)oxy-N-[(3-methyl-4-propoxy-phenyl)methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]ethanamide

Systemtic Name: 2-(2-iodanylpyridin-3-yl)oxy-N-[(3-methyl-4-propoxy-phenyl)methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]ethanamide Openeye Name: 2-[(2-iodo-3-pyridyl)oxy]-N-[(3-methyl-4-propoxy-phenyl)methyl]-N-[(3S)-2-oxoazepan-3-yl]acetamide CAS Name: 2-[(2-iodo-3-pyridinyl)oxy]-N-[(3-methyl-4-propoxyphenyl)methyl]-N-[(3S)-2-oxo-3-azepanyl]acetamide IUPAC Name: 2-(2-iodopyridin-3-yl)oxy-N-[(3-methyl-4-propoxyphenyl)methyl]-N-[(3S)-2-oxoazepan-3-yl]acetamide Traditional Name: 2-[(2-iodo-3-pyridyl)oxy]-N-[(3S)-2-ketoazepan-3-yl]-N-(3-methyl-4-propoxy-benzyl)acetamide Formula: C24H30IN3O4 MolecularWeight: 551.41717

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CN(C2CCCCNC2=O)C(=O)COC3=C(N=CC=C3)I)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CN([C@H]2CCCCNC2=O)C(=O)COC3=C(N=CC=C3)I)C

InChI

InChI=1S/C24H30IN3O4/c1-3-13-31-20-10-9-18(14-17(20)2)15-28(19-7-4-5-11-27-24(19)30)22(29)16-32-21-8-6-12-26-23(21)25/h6,8-10,12,14,19H,3-5,7,11,13,15-16H2,1-2H3,(H,27,30)/t19-/m0/s1