2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-(4-bromo-2-methylol-phenoxy)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC2=C(C=C(C=C2)Br)CO

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC2=C(C=C(C=C2)Br)CO

InChI

InChI=1S/C16H18BrNO3/c1-10-6-14(11(2)18(10)3)15(20)9-21-16-5-4-13(17)7-12(16)8-19/h4-7,19H,8-9H2,1-3H3