N-[3-(dioxidanylmethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodanyl-propanamide

Systemtic Name: N-[3-(dioxidanylmethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodanyl-propanamide Openeye Name: N-[3-(hydroperoxymethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodo-propanamide CAS Name: N-[3-(hydroperoxymethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodopropanamide IUPAC Name: N-[3-(hydroperoxymethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodopropanamide Traditional Name: N-[3-(hydroperoxymethyl)-5-methyl-1,2,4-triazin-6-yl]-3-iodo-propionamide Formula: C8H11IN4O3 MolecularWeight: 338.10241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NC(=N1)COO)NC(=O)CCI

Isomeric SMILES

CC1=C(N=NC(=N1)COO)NC(=O)CCI

InChI

InChI=1S/C8H11IN4O3/c1-5-8(11-7(14)2-3-9)13-12-6(10-5)4-16-15/h15H,2-4H2,1H3,(H,11,13,14)