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

Systemtic Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]cyclohexyl]methyl]-2-nitro-benzenesulfonamide Openeye Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]cyclohexyl]methyl]-2-nitro-benzenesulfonamide CAS Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]cyclohexyl]methyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]cyclohexyl]methyl]-2-nitrobenzenesulfonamide Traditional Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]cyclohexyl]methyl]-2-nitro-benzenesulfonamide Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNCC2=CC3=C(C=C2)OCCO3)CNS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1CNCC2=CC3=C(C=C2)OCCO3)CNS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O6S/c27-26(28)20-3-1-2-4-23(20)33(29,30)25-16-18-7-5-17(6-8-18)14-24-15-19-9-10-21-22(13-19)32-12-11-31-21/h1-4,9-10,13,17-18,24-25H,5-8,11-12,14-16H2