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

Systemtic Name: N-tert-butyl-4-(3-cyclohexyloxypropylamino)-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[3-(cyclohexoxy)propylamino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(3-cyclohexyloxypropylamino)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(3-cyclohexyloxypropylamino)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[3-(cyclohexoxy)propylamino]-3-nitro-benzenesulfonamide Formula: C19H31N3O5S MolecularWeight: 413.53154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCOC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCOC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C19H31N3O5S/c1-19(2,3)21-28(25,26)16-10-11-17(18(14-16)22(23)24)20-12-7-13-27-15-8-5-4-6-9-15/h10-11,14-15,20-21H,4-9,12-13H2,1-3H3