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

Systemtic Name: 4-[(2S)-2-(2-methoxyphenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate Openeye Name: 4-[(2S)-4-hydroxy-2-(2-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate CAS Name: 4-[(2S)-4-hydroxy-2-(2-methoxyphenyl)-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]butanoate IUPAC Name: 4-[(2S)-4-hydroxy-2-(2-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]butanoate Traditional Name: 4-[(5S)-3-hydroxy-2-keto-5-(2-methoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]butyrate Formula: C24H22NO6- MolecularWeight: 420.43458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2C(=C(C(=O)N2CCCC(=O)[O-])O)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1[C@H]2C(=C(C(=O)N2CCCC(=O)[O-])O)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H23NO6/c1-31-19-11-6-5-10-17(19)22-21(18(26)14-13-16-8-3-2-4-9-16)23(29)24(30)25(22)15-7-12-20(27)28/h2-6,8-11,13-14,22,29H,7,12,15H2,1H3,(H,27,28)/p-1/b14-13+/t22-/m0/s1