[1-azanyl-3-(4-nitrophenoxy)propan-2-yl]phosphonic acid

Systemtic Name: [1-azanyl-3-(4-nitrophenoxy)propan-2-yl]phosphonic acid Openeye Name: [1-(aminomethyl)-2-(4-nitrophenoxy)ethyl]phosphonic acid CAS Name: [1-amino-3-(4-nitrophenoxy)propan-2-yl]phosphonic acid IUPAC Name: [1-amino-3-(4-nitrophenoxy)propan-2-yl]phosphonic acid Traditional Name: [1-(aminomethyl)-2-(4-nitrophenoxy)ethyl]phosphonic acid Formula: C9H13N2O6P MolecularWeight: 276.183081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(CN)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(CN)P(=O)(O)O

InChI

InChI=1S/C9H13N2O6P/c10-5-9(18(14,15)16)6-17-8-3-1-7(2-4-8)11(12)13/h1-4,9H,5-6,10H2,(H2,14,15,16)