2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(4-bromo-2-methylol-phenoxy)-1-(4-phenylpiperazino)ethanone Formula: C19H21BrN2O3 MolecularWeight: 405.28564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)Br)CO

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)Br)CO

InChI

InChI=1S/C19H21BrN2O3/c20-16-6-7-18(15(12-16)13-23)25-14-19(24)22-10-8-21(9-11-22)17-4-2-1-3-5-17/h1-7,12,23H,8-11,13-14H2