2-(2-fluorophenyl)sulfanylethyl 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C18H17FN2O5S MolecularWeight: 392.401383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)F)SCCOC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)F)SCCOC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN2O5S/c19-15-3-1-2-4-16(15)27-12-11-26-17(22)9-10-20-18(23)13-5-7-14(8-6-13)21(24)25/h1-8H,9-12H2,(H,20,23)