1-azanyl-3-[bis(4-nitrophenyl)amino]urea

Systemtic Name: 1-azanyl-3-[bis(4-nitrophenyl)amino]urea Openeye Name: 1-amino-3-(4-nitro-N-(4-nitrophenyl)anilino)urea CAS Name: 1-amino-3-(4-nitro-N-(4-nitrophenyl)anilino)urea IUPAC Name: 1-amino-3-(4-nitro-N-(4-nitrophenyl)anilino)urea Traditional Name: 1-amino-3-(4-nitro-N-(4-nitrophenyl)anilino)urea Formula: C13H12N6O5 MolecularWeight: 332.27158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)NN)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O5/c14-15-13(20)16-17(9-1-5-11(6-2-9)18(21)22)10-3-7-12(8-4-10)19(23)24/h1-8H,14H2,(H2,15,16,20)