N-tert-butyl-3-nitro-4-(pentan-3-ylamino)benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-(pentan-3-ylamino)benzenesulfonamide Openeye Name: N-tert-butyl-4-(1-ethylpropylamino)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-(pentan-3-ylamino)benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-(pentan-3-ylamino)benzenesulfonamide Traditional Name: N-tert-butyl-4-(1-ethylpropylamino)-3-nitro-benzenesulfonamide Formula: C15H25N3O4S MolecularWeight: 343.4417

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H25N3O4S/c1-6-11(7-2)16-13-9-8-12(10-14(13)18(19)20)23(21,22)17-15(3,4)5/h8-11,16-17H,6-7H2,1-5H3