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

Systemtic Name: 6-[(2R)-2-(3-methoxyphenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid Openeye Name: 6-[(2R)-4-hydroxy-2-(3-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid CAS Name: 6-[(2R)-4-hydroxy-2-(3-methoxyphenyl)-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]hexanoic acid IUPAC Name: 6-[(2R)-4-hydroxy-2-(3-methoxyphenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid Traditional Name: 6-[(5R)-3-hydroxy-2-keto-5-(3-methoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]hexanoic acid Formula: C26H27NO6 MolecularWeight: 449.49568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO6/c1-33-20-12-8-11-19(17-20)24-23(21(28)15-14-18-9-4-2-5-10-18)25(31)26(32)27(24)16-7-3-6-13-22(29)30/h2,4-5,8-12,14-15,17,24,31H,3,6-7,13,16H2,1H3,(H,29,30)/b15-14+/t24-/m1/s1