4-[2-(2,4-dinitrophenoxy)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(2,4-dinitrophenoxy)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(2,4-dinitrophenoxy)acetyl]amino]benzoic acid CAS Name: 4-[[2-(2,4-dinitrophenoxy)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(2,4-dinitrophenoxy)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(2,4-dinitrophenoxy)acetyl]amino]benzoic acid Formula: C15H11N3O8 MolecularWeight: 361.26314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O8/c19-14(16-10-3-1-9(2-4-10)15(20)21)8-26-13-6-5-11(17(22)23)7-12(13)18(24)25/h1-7H,8H2,(H,16,19)(H,20,21)