6-[(2S)-2-(2-fluorophenyl)-4-oxidanidyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate

Systemtic Name: 6-[(2S)-2-(2-fluorophenyl)-4-oxidanidyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate Openeye Name: 6-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate CAS Name: 6-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]hexanoate IUPAC Name: 6-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate Traditional Name: 6-[(2S)-2-(2-fluorophenyl)-5-keto-4-oxido-3-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]hexanoate Formula: C25H22FNO5-2 MolecularWeight: 435.444283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)C2=C(C(=O)N(C2C3=CC=CC=C3F)CCCCCC(=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=O)N([C@@H]2C3=CC=CC=C3F)CCCCCC(=O)[O-])[O-]

InChI

InChI=1S/C25H24FNO5/c26-19-12-7-6-11-18(19)23-22(20(28)15-14-17-9-3-1-4-10-17)24(31)25(32)27(23)16-8-2-5-13-21(29)30/h1,3-4,6-7,9-12,14-15,23,31H,2,5,8,13,16H2,(H,29,30)/p-2/b15-14+/t23-/m1/s1