3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodanyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodanyl-4-methyl-phenyl)propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodo-4-methyl-phenyl)propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodo-4-methylphenyl)propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodo-4-methylphenyl)propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-iodo-4-methyl-phenyl)propionamide Formula: C18H18INO5S MolecularWeight: 487.30869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)I

InChI

InChI=1S/C18H18INO5S/c1-12-2-3-13(10-15(12)19)20-18(21)6-9-26(22,23)14-4-5-16-17(11-14)25-8-7-24-16/h2-5,10-11H,6-9H2,1H3,(H,20,21)