4-azanyl-N-[2-[(4-azanyl-3-nitro-phenyl)carbonylamino]ethyl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[2-[(4-azanyl-3-nitro-phenyl)carbonylamino]ethyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[2-[(4-amino-3-nitro-benzoyl)amino]ethyl]-3-nitro-benzamide CAS Name: 4-amino-N-[2-[[(4-amino-3-nitrophenyl)-oxomethyl]amino]ethyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[2-[(4-amino-3-nitrobenzoyl)amino]ethyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[2-[(4-amino-3-nitro-benzoyl)amino]ethyl]-3-nitro-benzamide Formula: C16H16N6O6 MolecularWeight: 388.33484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C16H16N6O6/c17-11-3-1-9(7-13(11)21(25)26)15(23)19-5-6-20-16(24)10-2-4-12(18)14(8-10)22(27)28/h1-4,7-8H,5-6,17-18H2,(H,19,23)(H,20,24)