3-(7-nitro-2-oxidanylidene-3-phenylmethoxy-quinolin-1-yl)propylphosphonic acid

Systemtic Name: 3-(7-nitro-2-oxidanylidene-3-phenylmethoxy-quinolin-1-yl)propylphosphonic acid Openeye Name: 3-(3-benzyloxy-7-nitro-2-oxo-1-quinolyl)propylphosphonic acid CAS Name: 3-(7-nitro-2-oxo-3-phenylmethoxy-1-quinolinyl)propylphosphonic acid IUPAC Name: 3-(7-nitro-2-oxo-3-phenylmethoxyquinolin-1-yl)propylphosphonic acid Traditional Name: 3-(3-benzoxy-2-keto-7-nitro-1-quinolyl)propylphosphonic acid Formula: C19H19N2O7P MolecularWeight: 418.337121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C(C=C3)[N+](=O)[O-])N(C2=O)CCCP(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C(C=C3)[N+](=O)[O-])N(C2=O)CCCP(=O)(O)O

InChI

InChI=1S/C19H19N2O7P/c22-19-18(28-13-14-5-2-1-3-6-14)11-15-7-8-16(21(23)24)12-17(15)20(19)9-4-10-29(25,26)27/h1-3,5-8,11-12H,4,9-10,13H2,(H2,25,26,27)