4-[4-[(3,5-dinitrophenyl)carbonylamino]phenoxy]phthalate

Systemtic Name: 4-[4-[(3,5-dinitrophenyl)carbonylamino]phenoxy]phthalate Openeye Name: 4-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]phthalate CAS Name: 4-[4-[[(3,5-dinitrophenyl)-oxomethyl]amino]phenoxy]phthalate IUPAC Name: 4-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]phthalate Traditional Name: 4-[4-[(3,5-dinitrobenzoyl)amino]phenoxy]phthalate Formula: C21H11N3O10-2 MolecularWeight: 465.32614

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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-])OC3=CC(=C(C=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OC3=CC(=C(C=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C21H13N3O10/c25-19(11-7-13(23(30)31)9-14(8-11)24(32)33)22-12-1-3-15(4-2-12)34-16-5-6-17(20(26)27)18(10-16)21(28)29/h1-10H,(H,22,25)(H,26,27)(H,28,29)/p-2