4-[2-(4-chloranyl-3-nitro-phenoxy)-1-nitro-ethoxy]benzene-1,3-diamine

Systemtic Name: 4-[2-(4-chloranyl-3-nitro-phenoxy)-1-nitro-ethoxy]benzene-1,3-diamine Openeye Name: 4-[2-(4-chloro-3-nitro-phenoxy)-1-nitro-ethoxy]benzene-1,3-diamine CAS Name: 4-[2-(4-chloro-3-nitrophenoxy)-1-nitroethoxy]benzene-1,3-diamine IUPAC Name: 4-[2-(4-chloro-3-nitrophenoxy)-1-nitroethoxy]benzene-1,3-diamine Traditional Name: [3-amino-4-[2-(4-chloro-3-nitro-phenoxy)-1-nitro-ethoxy]phenyl]amine Formula: C14H13ClN4O6 MolecularWeight: 368.72922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)N)OC(COC2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1N)N)OC(COC2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN4O6/c15-10-3-2-9(6-12(10)18(20)21)24-7-14(19(22)23)25-13-4-1-8(16)5-11(13)17/h1-6,14H,7,16-17H2