[(5-nitrofuran-2-yl)-[(phenylmethyl)amino]methyl]phosphonic acid

Systemtic Name: [(5-nitrofuran-2-yl)-[(phenylmethyl)amino]methyl]phosphonic acid Openeye Name: [(benzylamino)-(5-nitro-2-furyl)methyl]phosphonic acid CAS Name: [(5-nitro-2-furanyl)-[(phenylmethyl)amino]methyl]phosphonic acid IUPAC Name: [(benzylamino)-(5-nitrofuran-2-yl)methyl]phosphonic acid Traditional Name: [(benzylamino)-(5-nitro-2-furyl)methyl]phosphonic acid Formula: C12H13N2O6P MolecularWeight: 312.215181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C2=CC=C(O2)[N+](=O)[O-])P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(C2=CC=C(O2)[N+](=O)[O-])P(=O)(O)O

InChI

InChI=1S/C12H13N2O6P/c15-14(16)11-7-6-10(20-11)12(21(17,18)19)13-8-9-4-2-1-3-5-9/h1-7,12-13H,8H2,(H2,17,18,19)