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

Systemtic Name: 2-(2-bromanylpyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-(2-bromopyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-(2-bromo-1-pyrrolyl)-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-(2-bromopyrrol-1-yl)-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-(2-bromopyrrol-1-yl)-3-(4-hydroxyphenyl)propionic acid Formula: C13H12BrNO3 MolecularWeight: 310.14328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)Br)C(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

C1=CN(C(=C1)Br)C(CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C13H12BrNO3/c14-12-2-1-7-15(12)11(13(17)18)8-9-3-5-10(16)6-4-9/h1-7,11,16H,8H2,(H,17,18)