3-(3-azanyl-2-nitro-phenyl)pentan-3-ylphosphonic acid

Systemtic Name: 3-(3-azanyl-2-nitro-phenyl)pentan-3-ylphosphonic acid Openeye Name: [1-(3-amino-2-nitro-phenyl)-1-ethyl-propyl]phosphonic acid CAS Name: 3-(3-amino-2-nitrophenyl)pentan-3-ylphosphonic acid IUPAC Name: 3-(3-amino-2-nitrophenyl)pentan-3-ylphosphonic acid Traditional Name: [1-(3-amino-2-nitro-phenyl)-1-ethyl-propyl]phosphonic acid Formula: C11H17N2O5P MolecularWeight: 288.236841

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(C(=CC=C1)N)[N+](=O)[O-])P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=C(C(=CC=C1)N)[N+](=O)[O-])P(=O)(O)O

InChI

InChI=1S/C11H17N2O5P/c1-3-11(4-2,19(16,17)18)8-6-5-7-9(12)10(8)13(14)15/h5-7H,3-4,12H2,1-2H3,(H2,16,17,18)