2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)-methylsulfonyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-(3-chloro-4-fluoro-N-methylsulfonyl-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-(3-chloro-4-fluoro-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-(3-chloro-4-fluoro-N-mesyl-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C17H16ClFN2O5S MolecularWeight: 414.835743

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC2=C(C=C1)OCCO2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC2=C(C=C1)OCCO2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H16ClFN2O5S/c1-27(23,24)21(12-3-4-14(19)13(18)9-12)10-17(22)20-11-2-5-15-16(8-11)26-7-6-25-15/h2-5,8-9H,6-7,10H2,1H3,(H,20,22)