4-azanyl-2,3-dinitro-N,N-dipropyl-benzenesulfonamide

Systemtic Name: 4-azanyl-2,3-dinitro-N,N-dipropyl-benzenesulfonamide Openeye Name: 4-amino-2,3-dinitro-N,N-dipropyl-benzenesulfonamide CAS Name: 4-amino-2,3-dinitro-N,N-dipropylbenzenesulfonamide IUPAC Name: 4-amino-2,3-dinitro-N,N-dipropylbenzenesulfonamide Traditional Name: 4-amino-2,3-dinitro-N,N-dipropyl-benzenesulfonamide Formula: C12H18N4O6S MolecularWeight: 346.35952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O6S/c1-3-7-14(8-4-2)23(21,22)10-6-5-9(13)11(15(17)18)12(10)16(19)20/h5-6H,3-4,7-8,13H2,1-2H3