[(2,6-dinitro-3-phenylazanyl-phenyl)-phenyl-methyl] 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: [(2,6-dinitro-3-phenylazanyl-phenyl)-phenyl-methyl] 2,2,2-tris(chloranyl)ethanoate Openeye Name: [(3-anilino-2,6-dinitro-phenyl)-phenyl-methyl] 2,2,2-trichloroacetate CAS Name: 2,2,2-trichloroacetic acid [(3-anilino-2,6-dinitrophenyl)-phenylmethyl] ester IUPAC Name: [(3-anilino-2,6-dinitrophenyl)-phenylmethyl] 2,2,2-trichloroacetate Traditional Name: 2,2,2-trichloroacetic acid [(3-anilino-2,6-dinitro-phenyl)-phenyl-methyl] ester Formula: C21H14Cl3N3O6 MolecularWeight: 510.71136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C=CC(=C2[N+](=O)[O-])NC3=CC=CC=C3)[N+](=O)[O-])OC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C=CC(=C2[N+](=O)[O-])NC3=CC=CC=C3)[N+](=O)[O-])OC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C21H14Cl3N3O6/c22-21(23,24)20(28)33-19(13-7-3-1-4-8-13)17-16(26(29)30)12-11-15(18(17)27(31)32)25-14-9-5-2-6-10-14/h1-12,19,25H