ethyl 3-[[(1R)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[(1R)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(1R)-1-(3-fluoro-4-methoxy-phenyl)ethyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(1R)-1-(3-fluoro-4-methoxyphenyl)ethyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(1R)-1-(3-fluoro-4-methoxy-phenyl)ethyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H19FN2O6 MolecularWeight: 390.362363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C)C2=CC(=C(C=C2)OC)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N[C@H](C)C2=CC(=C(C=C2)OC)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19FN2O6/c1-4-28-19(24)14-7-13(8-15(9-14)22(25)26)18(23)21-11(2)12-5-6-17(27-3)16(20)10-12/h5-11H,4H2,1-3H3,(H,21,23)/t11-/m1/s1