5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one

Systemtic Name: 5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one Openeye Name: 5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one CAS Name: 5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one IUPAC Name: 5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one Traditional Name: 5-(2-diethylaminoethylamino)-4,6-dinitro-1,4-dihydrobenzimidazol-2-one Formula: C13H18N6O5 MolecularWeight: 338.31922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C(C=C2C(=NC(=O)N2)C1[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNC1=C(C=C2C(=NC(=O)N2)C1[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H18N6O5/c1-3-17(4-2)6-5-14-11-9(18(21)22)7-8-10(12(11)19(23)24)16-13(20)15-8/h7,12,14H,3-6H2,1-2H3,(H,15,20)