3-(4-acetyloxyphenyl)-2-(3-ethanoyl-2,5-dimethyl-pyrrol-1-yl)propanoic acid

Systemtic Name: 3-(4-acetyloxyphenyl)-2-(3-ethanoyl-2,5-dimethyl-pyrrol-1-yl)propanoic acid Openeye Name: 3-(4-acetoxyphenyl)-2-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)propanoic acid CAS Name: 2-(3-acetyl-2,5-dimethyl-1-pyrrolyl)-3-(4-acetyloxyphenyl)propanoic acid IUPAC Name: 2-(3-acetyl-2,5-dimethylpyrrol-1-yl)-3-(4-acetyloxyphenyl)propanoic acid Traditional Name: 3-(4-acetoxyphenyl)-2-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)propionic acid Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(CC2=CC=C(C=C2)OC(=O)C)C(=O)O)C)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1C(CC2=CC=C(C=C2)OC(=O)C)C(=O)O)C)C(=O)C

InChI

InChI=1S/C19H21NO5/c1-11-9-17(13(3)21)12(2)20(11)18(19(23)24)10-15-5-7-16(8-6-15)25-14(4)22/h5-9,18H,10H2,1-4H3,(H,23,24)