(E)-4-bromanylpent-2-enoic acid; 4-phenoxyphenol

Systemtic Name: (E)-4-bromanylpent-2-enoic acid; 4-phenoxyphenol Openeye Name: (E)-4-bromopent-2-enoic acid; 4-phenoxyphenol CAS Name: (E)-4-bromo-2-pentenoic acid; 4-phenoxyphenol IUPAC Name: (E)-4-bromopent-2-enoic acid; 4-phenoxyphenol Traditional Name: (E)-4-bromopent-2-enoic acid; 4-phenoxyphenol Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(=O)O)Br.C1=CC=C(C=C1)OC2=CC=C(C=C2)O

Isomeric SMILES

CC(/C=C/C(=O)O)Br.C1=CC=C(C=C1)OC2=CC=C(C=C2)O

InChI

InChI=1S/C12H10O2.C5H7BrO2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;1-4(6)2-3-5(7)8/h1-9,13H;2-4H,1H3,(H,7,8)/b;3-2+