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

Systemtic Name: 6-[(2S)-2-(4-methoxyphenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate Openeye Name: 6-[(2S)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate CAS Name: 6-[(2S)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]hexanoate IUPAC Name: 6-[(2S)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoate Traditional Name: 6-[(5S)-3-hydroxy-2-keto-5-(4-methoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]hexanoate Formula: C26H26NO6- MolecularWeight: 448.48774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(C(=O)N2CCCCCC(=O)[O-])O)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2CCCCCC(=O)[O-])O)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H27NO6/c1-33-20-14-12-19(13-15-20)24-23(21(28)16-11-18-8-4-2-5-9-18)25(31)26(32)27(24)17-7-3-6-10-22(29)30/h2,4-5,8-9,11-16,24,31H,3,6-7,10,17H2,1H3,(H,29,30)/p-1/b16-11+/t24-/m0/s1