magnesium; benzene; 3-[4-(diphenylmethyl)piperazin-1-yl]propan-1-olate; bromide

Systemtic Name: magnesium; benzene; 3-[4-(diphenylmethyl)piperazin-1-yl]propan-1-olate; bromide Openeye Name: magnesium; benzene; 3-(4-benzhydrylpiperazin-1-yl)propan-1-olate; bromide CAS Name: magnesium; benzene; 3-[4-(diphenylmethyl)-1-piperazinyl]-1-propanolate; bromide IUPAC Name: magnesium; benzene; 3-(4-benzhydrylpiperazin-1-yl)propan-1-olate; bromide Traditional Name: magnesium; benzene; 3-(4-benzhydrylpiperazino)propan-1-olate; bromide Formula: C26H30BrMgN2O- MolecularWeight: 490.7382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC[O-])C(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=[C-]C=C1.[Mg+2].[Br-]

Isomeric SMILES

C1CN(CCN1CCC[O-])C(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=[C-]C=C1.[Mg+2].[Br-]

InChI

InChI=1S/C20H25N2O.C6H5.BrH.Mg/c23-17-7-12-21-13-15-22(16-14-21)20(18-8-3-1-4-9-18)19-10-5-2-6-11-19;1-2-4-6-5-3-1;;/h1-6,8-11,20H,7,12-17H2;1-5H;1H;/q2*-1;;+2/p-1