N1,N2-bis(2-azanylethyl)-3-(4-nitrophenyl)propane-1,2-diamine

Systemtic Name: N1,N2-bis(2-azanylethyl)-3-(4-nitrophenyl)propane-1,2-diamine Openeye Name: N1,N2-bis(2-aminoethyl)-3-(4-nitrophenyl)propane-1,2-diamine CAS Name: N1,N2-bis(2-aminoethyl)-3-(4-nitrophenyl)propane-1,2-diamine IUPAC Name: 1-N,2-N-bis(2-aminoethyl)-3-(4-nitrophenyl)propane-1,2-diamine Traditional Name: 2-aminoethyl-[1-[(2-aminoethylamino)methyl]-2-(4-nitrophenyl)ethyl]amine Formula: C13H23N5O2 MolecularWeight: 281.35402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CNCCN)NCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(CNCCN)NCCN)[N+](=O)[O-]

InChI

InChI=1S/C13H23N5O2/c14-5-7-16-10-12(17-8-6-15)9-11-1-3-13(4-2-11)18(19)20/h1-4,12,16-17H,5-10,14-15H2