N,N'-bis(2,3,4-trinitrophenyl)pentane-1,5-diamine

Systemtic Name: N,N'-bis(2,3,4-trinitrophenyl)pentane-1,5-diamine Openeye Name: N,N'-bis(2,3,4-trinitrophenyl)pentane-1,5-diamine CAS Name: N,N'-bis(2,3,4-trinitrophenyl)pentane-1,5-diamine IUPAC Name: N,N'-bis(2,3,4-trinitrophenyl)pentane-1,5-diamine Traditional Name: 5-(2,3,4-trinitroanilino)pentyl-(2,3,4-trinitrophenyl)amine Formula: C17H16N8O12 MolecularWeight: 524.35534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1NCCCCCNC2=C(C(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1NCCCCCNC2=C(C(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N8O12/c26-20(27)12-6-4-10(14(22(30)31)16(12)24(34)35)18-8-2-1-3-9-19-11-5-7-13(21(28)29)17(25(36)37)15(11)23(32)33/h4-7,18-19H,1-3,8-9H2