N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(2-thienylmethyl)benzenesulfonamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-3-nitro-N-(2-thenyl)benzenesulfonamide Formula: C20H18N2O6S2 MolecularWeight: 446.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6S2/c1-14-4-6-17(12-18(14)22(23)24)30(25,26)21(13-16-3-2-10-29-16)15-5-7-19-20(11-15)28-9-8-27-19/h2-7,10-12H,8-9,13H2,1H3