1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazin-4-ium

Systemtic Name: 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazin-4-ium Openeye Name: 1-[4-[4-(1,1-dimethylpropyl)phenoxy]butyl]-4-methyl-piperazin-1-ium CAS Name: 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazin-4-ium IUPAC Name: 1-methyl-4-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]piperazin-4-ium Traditional Name: 1-[4-(4-tert-amylphenoxy)butyl]-4-methyl-piperazin-1-ium Formula: C20H35N2O+ MolecularWeight: 319.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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