[[4-(4-nitrophenoxy)-2-phosphonato-butyl]amino] phosphate

Systemtic Name: [[4-(4-nitrophenoxy)-2-phosphonato-butyl]amino] phosphate Openeye Name: [[4-(4-nitrophenoxy)-2-phosphonato-butyl]amino] phosphate CAS Name: [[4-(4-nitrophenoxy)-2-phosphonatobutyl]amino] phosphate IUPAC Name: [[4-(4-nitrophenoxy)-2-phosphonatobutyl]amino] phosphate Traditional Name: [[4-(4-nitrophenoxy)-2-phosphonato-butyl]amino] phosphate Formula: C10H12N2O10P2-4 MolecularWeight: 382.157202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCCC(CNOP(=O)([O-])[O-])P(=O)([O-])[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCCC(CNOP(=O)([O-])[O-])P(=O)([O-])[O-]

InChI

InChI=1S/C10H16N2O10P2/c13-12(14)8-1-3-9(4-2-8)21-6-5-10(23(15,16)17)7-11-22-24(18,19)20/h1-4,10-11H,5-7H2,(H2,15,16,17)(H2,18,19,20)/p-4