2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-iodanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C17H17IN2O5S MolecularWeight: 488.29675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C17H17IN2O5S/c1-11-7-12(18)3-5-14(11)19-17(21)9-20(26(2,22)23)13-4-6-15-16(8-13)25-10-24-15/h3-8H,9-10H2,1-2H3,(H,19,21)