2-(2-butanoylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-(2-butanoylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(2-butanoylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[2-(1-oxobutyl)-1-pyrrolyl]propanoic acid IUPAC Name: 2-(2-butanoylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(2-butyrylpyrrol-1-yl)-3-(4-hydroxyphenyl)propionic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4/c1-2-4-16(20)14-5-3-10-18(14)15(17(21)22)11-12-6-8-13(19)9-7-12/h3,5-10,15,19H,2,4,11H2,1H3,(H,21,22)