1-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[4-(2-tert-butyl-5-methylphenoxy)butyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[4-(2-tert-butyl-5-methylphenoxy)butyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[4-(2-tert-butyl-5-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium Formula: C20H36N2O+2 MolecularWeight: 320.51264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C20H34N2O/c1-17-8-9-18(20(2,3)4)19(16-17)23-15-7-6-10-22-13-11-21(5)12-14-22/h8-9,16H,6-7,10-15H2,1-5H3/p+2