1-ethyl-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]piperazine-1,4-diium

Systemtic Name: 1-ethyl-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]piperazine-1,4-diium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCOC2=C(C=CC(=C2)C)C(C)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCOC2=C(C=CC(=C2)C)C(C)C

InChI

InChI=1S/C18H30N2O/c1-5-19-8-10-20(11-9-19)12-13-21-18-14-16(4)6-7-17(18)15(2)3/h6-7,14-15H,5,8-13H2,1-4H3/p+2