4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitro-benzenesulfonamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitro-benzenesulfonamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitrobenzenesulfonamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-tert-butyl-3-nitro-benzenesulfonamide Formula: C17H18N2O7S MolecularWeight: 394.39902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O7S/c1-17(2,3)18-27(22,23)12-5-7-14(13(9-12)19(20)21)26-11-4-6-15-16(8-11)25-10-24-15/h4-9,18H,10H2,1-3H3