1-methyl-4-[2-(4-methyl-2-prop-2-enyl-phenoxy)ethyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[2-(4-methyl-2-prop-2-enyl-phenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-[2-(2-allyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-methyl-4-[2-(4-methyl-2-prop-2-enylphenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[2-(4-methyl-2-prop-2-enylphenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(2-allyl-4-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C17H28N2O+2 MolecularWeight: 276.41702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-4-5-16-14-15(2)6-7-17(16)20-13-12-19-10-8-18(3)9-11-19/h4,6-7,14H,1,5,8-13H2,2-3H3/p+2