2-[4-[(3,5-dinitrophenyl)carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(3,5-dinitrophenyl)carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]acetic acid CAS Name: 2-[4-[[(3,5-dinitrophenyl)-oxomethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]acetic acid Traditional Name: 2-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]acetic acid Formula: C15H11N3O8 MolecularWeight: 361.26314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OCC(=O)O

InChI

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