N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC3=C(C=C2)OC(=N3)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC3=C(C=C2)OC(=N3)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-11-8-14(22(23)24)10-17(12(11)2)28(25,26)21-13-6-7-16-15(9-13)20-18(27-16)19(3,4)5/h6-10,21H,1-5H3