(5-fluoranyl-2-nitro-phenyl) 3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]propanoate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]propanoate Openeye Name: (5-fluoro-2-nitro-phenyl) 3-[[4-oxo-4-(2-thienyl)butanoyl]amino]propanoate CAS Name: 3-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]propanoic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]propanoate Traditional Name: 3-[[4-keto-4-(2-thienyl)butanoyl]amino]propionic acid (5-fluoro-2-nitro-phenyl) ester Formula: C17H15FN2O6S MolecularWeight: 394.374203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CCC(=O)NCCC(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C(=O)CCC(=O)NCCC(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H15FN2O6S/c18-11-3-4-12(20(24)25)14(10-11)26-17(23)7-8-19-16(22)6-5-13(21)15-2-1-9-27-15/h1-4,9-10H,5-8H2,(H,19,22)