3-nitro-2,5-dipropyl-benzenesulfonamide

Systemtic Name: 3-nitro-2,5-dipropyl-benzenesulfonamide Openeye Name: 3-nitro-2,5-dipropyl-benzenesulfonamide CAS Name: 3-nitro-2,5-dipropylbenzenesulfonamide IUPAC Name: 3-nitro-2,5-dipropylbenzenesulfonamide Traditional Name: 3-nitro-2,5-dipropyl-benzenesulfonamide Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)S(=O)(=O)N)CCC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=C(C(=C1)S(=O)(=O)N)CCC)[N+](=O)[O-]

InChI

InChI=1S/C12H18N2O4S/c1-3-5-9-7-11(14(15)16)10(6-4-2)12(8-9)19(13,17)18/h7-8H,3-6H2,1-2H3,(H2,13,17,18)