4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S/c1-18-27(23,24)13-3-4-14(15(11-13)20(21)22)19-7-6-12-2-5-16-17(10-12)26-9-8-25-16/h2-5,10-11,18-19H,6-9H2,1H3