4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Formula: C21H18N2O7S MolecularWeight: 442.44182

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O7S/c1-2-22(15-6-4-3-5-7-15)31(26,27)17-9-11-19(18(13-17)23(24)25)30-16-8-10-20-21(12-16)29-14-28-20/h3-13H,2,14H2,1H3