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

Systemtic Name: 4-(1,3-benzodioxol-5-ylamino)-N-tert-butyl-3-nitro-benzenesulfonamide Openeye Name: 4-(1,3-benzodioxol-5-ylamino)-N-tert-butyl-3-nitro-benzenesulfonamide CAS Name: 4-(1,3-benzodioxol-5-ylamino)-N-tert-butyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(1,3-benzodioxol-5-ylamino)-N-tert-butyl-3-nitrobenzenesulfonamide Traditional Name: 4-(1,3-benzodioxol-5-ylamino)-N-tert-butyl-3-nitro-benzenesulfonamide Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O6S/c1-17(2,3)19-27(23,24)12-5-6-13(14(9-12)20(21)22)18-11-4-7-15-16(8-11)26-10-25-15/h4-9,18-19H,10H2,1-3H3