[(4-nitrosophenyl)amino] 3,5-dinitrobenzoate

Systemtic Name: [(4-nitrosophenyl)amino] 3,5-dinitrobenzoate Openeye Name: (4-nitrosoanilino) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (4-nitrosoanilino) ester IUPAC Name: (4-nitrosoanilino) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (4-nitrosoanilino) ester Formula: C13H8N4O7 MolecularWeight: 332.22522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=O

Isomeric SMILES

C1=CC(=CC=C1NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=O

InChI

InChI=1S/C13H8N4O7/c18-13(24-15-10-3-1-9(14-19)2-4-10)8-5-11(16(20)21)7-12(6-8)17(22)23/h1-7,15H