1-[2-(3-bromanylphenoxy)-4-(phenylmethyl)piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[2-(3-bromanylphenoxy)-4-(phenylmethyl)piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-benzyl-2-(3-bromophenoxy)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[2-(3-bromophenoxy)-4-(phenylmethyl)-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-benzyl-2-(3-bromophenoxy)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-benzyl-2-(3-bromophenoxy)piperazino]-2-methyl-propan-1-one Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1OC2=CC(=CC=C2)Br)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1OC2=CC(=CC=C2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C21H25BrN2O2/c1-16(2)21(25)24-12-11-23(14-17-7-4-3-5-8-17)15-20(24)26-19-10-6-9-18(22)13-19/h3-10,13,16,20H,11-12,14-15H2,1-2H3