3-(4-acetyloxyphenyl)-2-(2-ethanoylpyrrol-1-yl)propanoic acid

Systemtic Name: 3-(4-acetyloxyphenyl)-2-(2-ethanoylpyrrol-1-yl)propanoic acid Openeye Name: 3-(4-acetoxyphenyl)-2-(2-acetylpyrrol-1-yl)propanoic acid CAS Name: 3-(4-acetyloxyphenyl)-2-(2-acetyl-1-pyrrolyl)propanoic acid IUPAC Name: 3-(4-acetyloxyphenyl)-2-(2-acetylpyrrol-1-yl)propanoic acid Traditional Name: 3-(4-acetoxyphenyl)-2-(2-acetylpyrrol-1-yl)propionic acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CN1C(CC2=CC=C(C=C2)OC(=O)C)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=CN1C(CC2=CC=C(C=C2)OC(=O)C)C(=O)O

InChI

InChI=1S/C17H17NO5/c1-11(19)15-4-3-9-18(15)16(17(21)22)10-13-5-7-14(8-6-13)23-12(2)20/h3-9,16H,10H2,1-2H3,(H,21,22)