N-(4-methylcyclohexyl)-3-nitro-4-(3-propan-2-yloxypropylamino)benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-propan-2-yloxypropylamino)benzenesulfonamide Openeye Name: 4-(3-isopropoxypropylamino)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-propan-2-yloxypropylamino)benzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-3-nitro-4-(3-propan-2-yloxypropylamino)benzenesulfonamide Traditional Name: 4-(3-isopropoxypropylamino)-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Formula: C19H31N3O5S MolecularWeight: 413.53154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCCCOC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCCCOC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H31N3O5S/c1-14(2)27-12-4-11-20-18-10-9-17(13-19(18)22(23)24)28(25,26)21-16-7-5-15(3)6-8-16/h9-10,13-16,20-21H,4-8,11-12H2,1-3H3