N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N,2-dimethyl-5-nitro-benzenesulfonamide Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2COC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)CC2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H18N2O6S/c1-12-7-8-13(19(20)21)9-17(12)26(22,23)18(2)10-14-11-24-15-5-3-4-6-16(15)25-14/h3-9,14H,10-11H2,1-2H3