N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-chloro-3-nitro-benzenesulfonamide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S/c1-17(2,3)16-19-13-8-10(4-7-15(13)26-16)20-27(24,25)11-5-6-12(18)14(9-11)21(22)23/h4-9,20H,1-3H3