N1,N3-dibutyl-2,4-dinitro-benzene-1,3-diamine

Systemtic Name: N1,N3-dibutyl-2,4-dinitro-benzene-1,3-diamine Openeye Name: N1,N3-dibutyl-2,4-dinitro-benzene-1,3-diamine CAS Name: N1,N3-dibutyl-2,4-dinitrobenzene-1,3-diamine IUPAC Name: 1-N,3-N-dibutyl-2,4-dinitrobenzene-1,3-diamine Traditional Name: butyl-[3-(butylamino)-2,4-dinitro-phenyl]amine Formula: C14H22N4O4 MolecularWeight: 310.34888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=C(C=C1)[N+](=O)[O-])NCCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C(=C(C=C1)[N+](=O)[O-])NCCCC)[N+](=O)[O-]

InChI

InChI=1S/C14H22N4O4/c1-3-5-9-15-11-7-8-12(17(19)20)13(14(11)18(21)22)16-10-6-4-2/h7-8,15-16H,3-6,9-10H2,1-2H3