4-(diphenylmethyl)-1,1-diethyl-piperazin-1-ium iodide

Systemtic Name: 4-(diphenylmethyl)-1,1-diethyl-piperazin-1-ium iodide Openeye Name: 4-benzhydryl-1,1-diethyl-piperazin-1-ium iodide CAS Name: 4-(diphenylmethyl)-1,1-diethylpiperazin-1-ium iodide IUPAC Name: 4-benzhydryl-1,1-diethylpiperazin-1-ium iodide Traditional Name: 4-benzhydryl-1,1-diethyl-piperazin-1-ium iodide Formula: C21H29IN2 MolecularWeight: 436.37283

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)CC.[I-]

Isomeric SMILES

CC[N+]1(CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)CC.[I-]

InChI

InChI=1S/C21H29N2.HI/c1-3-23(4-2)17-15-22(16-18-23)21(19-11-7-5-8-12-19)20-13-9-6-10-14-20;/h5-14,21H,3-4,15-18H2,1-2H3;1H/q+1;/p-1