6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol

Systemtic Name: 6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol Openeye Name: 6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol CAS Name: 6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol IUPAC Name: 6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol Traditional Name: 6-[ethoxy-(4-nitrophenoxy)phosphoryl]hexanenitrile; 4-nitrophenol Formula: C20H24N3O8P MolecularWeight: 465.393621

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCCCC#N)OC1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CCOP(=O)(CCCCCC#N)OC1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C14H19N2O5P.C6H5NO3/c1-2-20-22(19,12-6-4-3-5-11-15)21-14-9-7-13(8-10-14)16(17)18;8-6-3-1-5(2-4-6)7(9)10/h7-10H,2-6,12H2,1H3;1-4,8H