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

Systemtic Name: 2-(3-ethanoyl-2,5-dimethyl-pyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-(3-acetyl-2,5-dimethyl-1-pyrrolyl)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(3-acetyl-2,5-dimethylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(3-acetyl-2,5-dimethyl-pyrrol-1-yl)-3-(4-hydroxyphenyl)propionic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4/c1-10-8-15(12(3)19)11(2)18(10)16(17(21)22)9-13-4-6-14(20)7-5-13/h4-8,16,20H,9H2,1-3H3,(H,21,22)