N1,N3-bis(2-methoxyethyl)-4,6-dinitro-benzene-1,3-diamine

Systemtic Name: N1,N3-bis(2-methoxyethyl)-4,6-dinitro-benzene-1,3-diamine Openeye Name: N1,N3-bis(2-methoxyethyl)-4,6-dinitro-benzene-1,3-diamine CAS Name: N1,N3-bis(2-methoxyethyl)-4,6-dinitrobenzene-1,3-diamine IUPAC Name: 1-N,3-N-bis(2-methoxyethyl)-4,6-dinitrobenzene-1,3-diamine Traditional Name: 2-methoxyethyl-[5-(2-methoxyethylamino)-2,4-dinitro-phenyl]amine Formula: C12H18N4O6 MolecularWeight: 314.29452

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCOC

Isomeric SMILES

COCCNC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCOC

InChI

InChI=1S/C12H18N4O6/c1-21-5-3-13-9-7-10(14-4-6-22-2)12(16(19)20)8-11(9)15(17)18/h7-8,13-14H,3-6H2,1-2H3