methyl 2,4-dimethyl-5-[(2S)-2-[2-(6-oxidanyl-1-benzofuran-3-yl)ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[(2S)-2-[2-(6-oxidanyl-1-benzofuran-3-yl)ethanoyloxy]propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(2S)-2-[2-(6-hydroxybenzofuran-3-yl)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-[2-(6-hydroxy-3-benzofuranyl)-1-oxoethoxy]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-2-[2-(6-hydroxy-1-benzofuran-3-yl)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-[2-(6-hydroxybenzofuran-3-yl)acetyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CC2=COC3=C2C=CC(=C3)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC(=O)CC2=COC3=C2C=CC(=C3)O

InChI

InChI=1S/C21H21NO7/c1-10-18(21(26)27-4)11(2)22-19(10)20(25)12(3)29-17(24)7-13-9-28-16-8-14(23)5-6-15(13)16/h5-6,8-9,12,22-23H,7H2,1-4H3/t12-/m0/s1