N-[1-(2-bromanyl-3-iodanyl-4-propan-2-ylsulfonyl-phenyl)-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-(2-bromanyl-3-iodanyl-4-propan-2-ylsulfonyl-phenyl)-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-(2-bromo-3-iodo-4-isopropylsulfonyl-phenyl)-3-oxo-propyl]formamide CAS Name: N-[1-(2-bromo-3-iodo-4-propan-2-ylsulfonylphenyl)-3-oxopropyl]formamide IUPAC Name: N-[1-(2-bromo-3-iodo-4-propan-2-ylsulfonylphenyl)-3-oxopropyl]formamide Traditional Name: N-[1-(2-bromo-3-iodo-4-isopropylsulfonyl-phenyl)-3-keto-propyl]formamide Formula: C13H15BrINO4S MolecularWeight: 488.13597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C(=C(C=C1)C(CC=O)NC=O)Br)I

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C(=C(C=C1)C(CC=O)NC=O)Br)I

InChI

InChI=1S/C13H15BrINO4S/c1-8(2)21(19,20)11-4-3-9(12(14)13(11)15)10(5-6-17)16-7-18/h3-4,6-8,10H,5H2,1-2H3,(H,16,18)