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

Systemtic Name: 1-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C16H25ClN2O+2 MolecularWeight: 296.8355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23ClN2O/c1-3-4-14-13-15(17)5-6-16(14)20-12-11-19-9-7-18(2)8-10-19/h3,5-6,13H,1,4,7-12H2,2H3/p+2