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

Systemtic Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(esyl)amino]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C18H19IN2O5S MolecularWeight: 502.32333

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)I)C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NC1=C(C=C(C=C1)I)C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19IN2O5S/c1-3-27(23,24)21(14-5-7-16-17(9-14)26-11-25-16)10-18(22)20-15-6-4-13(19)8-12(15)2/h4-9H,3,10-11H2,1-2H3,(H,20,22)