4-[2-(diphenylmethyl)oxyethyl]-1,1-dimethyl-piperazin-1-ium iodide

Systemtic Name: 4-[2-(diphenylmethyl)oxyethyl]-1,1-dimethyl-piperazin-1-ium iodide Openeye Name: 4-(2-benzhydryloxyethyl)-1,1-dimethyl-piperazin-1-ium iodide CAS Name: 4-[2-(diphenylmethyl)oxyethyl]-1,1-dimethylpiperazin-1-ium iodide IUPAC Name: 4-(2-benzhydryloxyethyl)-1,1-dimethylpiperazin-1-ium iodide Traditional Name: 4-(2-benzhydryloxyethyl)-1,1-dimethyl-piperazin-1-ium iodide Formula: C21H29IN2O MolecularWeight: 452.37223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N2O.HI/c1-23(2)16-13-22(14-17-23)15-18-24-21(19-9-5-3-6-10-19)20-11-7-4-8-12-20;/h3-12,21H,13-18H2,1-2H3;1H/q+1;/p-1