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

Systemtic Name: 4-[(2S)-2-(2-fluorophenyl)-4-oxidanidyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate Openeye Name: 4-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate CAS Name: 4-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]butanoate IUPAC Name: 4-[(2S)-2-(2-fluorophenyl)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate Traditional Name: 4-[(2S)-2-(2-fluorophenyl)-5-keto-4-oxido-3-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]butyrate Formula: C23H18FNO5-2 MolecularWeight: 407.391123

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)CCCC(=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)CCCC(=O)[O-])[O-]

InChI

InChI=1S/C23H20FNO5/c24-17-10-5-4-9-16(17)21-20(18(26)13-12-15-7-2-1-3-8-15)22(29)23(30)25(21)14-6-11-19(27)28/h1-5,7-10,12-13,21,29H,6,11,14H2,(H,27,28)/p-2/b13-12+/t21-/m1/s1