dibutyl (3-nitrophenyl) phosphate

Systemtic Name: dibutyl (3-nitrophenyl) phosphate Openeye Name: dibutyl (3-nitrophenyl) phosphate CAS Name: phosphoric acid dibutyl (3-nitrophenyl) ester IUPAC Name: dibutyl (3-nitrophenyl) phosphate Traditional Name: phosphoric acid dibutyl (3-nitrophenyl) ester Formula: C14H22NO6P MolecularWeight: 331.301341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(OCCCC)OC1=CC=CC(=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCOP(=O)(OCCCC)OC1=CC=CC(=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H22NO6P/c1-3-5-10-19-22(18,20-11-6-4-2)21-14-9-7-8-13(12-14)15(16)17/h7-9,12H,3-6,10-11H2,1-2H3