[4-(4-cyanophenoxy)-3-nitro-phenoxy]methylphosphonic acid

Systemtic Name: [4-(4-cyanophenoxy)-3-nitro-phenoxy]methylphosphonic acid Openeye Name: [4-(4-cyanophenoxy)-3-nitro-phenoxy]methylphosphonic acid CAS Name: [4-(4-cyanophenoxy)-3-nitrophenoxy]methylphosphonic acid IUPAC Name: [4-(4-cyanophenoxy)-3-nitrophenoxy]methylphosphonic acid Traditional Name: [4-(4-cyanophenoxy)-3-nitro-phenoxy]methylphosphonic acid Formula: C14H11N2O7P MolecularWeight: 350.220101

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC2=C(C=C(C=C2)OCP(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)OC2=C(C=C(C=C2)OCP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H11N2O7P/c15-8-10-1-3-11(4-2-10)23-14-6-5-12(7-13(14)16(17)18)22-9-24(19,20)21/h1-7H,9H2,(H2,19,20,21)