N-tert-butyl-4-(butylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(butylamino)-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(butylamino)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(butylamino)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(butylamino)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(butylamino)-3-nitro-benzenesulfonamide Formula: C14H23N3O4S MolecularWeight: 329.41512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H23N3O4S/c1-5-6-9-15-12-8-7-11(10-13(12)17(18)19)22(20,21)16-14(2,3)4/h7-8,10,15-16H,5-6,9H2,1-4H3