N,N'-bis[(3-nitrophenyl)methyl]propane-1,3-diamine

Systemtic Name: N,N'-bis[(3-nitrophenyl)methyl]propane-1,3-diamine Openeye Name: N,N'-bis[(3-nitrophenyl)methyl]propane-1,3-diamine CAS Name: N,N'-bis[(3-nitrophenyl)methyl]propane-1,3-diamine IUPAC Name: N,N'-bis[(3-nitrophenyl)methyl]propane-1,3-diamine Traditional Name: (3-nitrobenzyl)-[3-[(3-nitrobenzyl)amino]propyl]amine Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNCCCNCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNCCCNCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c22-20(23)16-6-1-4-14(10-16)12-18-8-3-9-19-13-15-5-2-7-17(11-15)21(24)25/h1-2,4-7,10-11,18-19H,3,8-9,12-13H2