4-azanyl-3,5-dinitro-N,N-dipropyl-benzenesulfonamide

Systemtic Name: 4-azanyl-3,5-dinitro-N,N-dipropyl-benzenesulfonamide Openeye Name: 4-amino-3,5-dinitro-N,N-dipropyl-benzenesulfonamide CAS Name: 4-amino-3,5-dinitro-N,N-dipropylbenzenesulfonamide IUPAC Name: 4-amino-3,5-dinitro-N,N-dipropylbenzenesulfonamide Traditional Name: 4-amino-3,5-dinitro-N,N-dipropyl-benzenesulfonamide Formula: C12H18N4O6S MolecularWeight: 346.35952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)23(21,22)9-7-10(15(17)18)12(13)11(8-9)16(19)20/h7-8H,3-6,13H2,1-2H3