1-[2-(2-chloranyl-6-prop-2-enyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-(2-chloranyl-6-prop-2-enyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-(2-allyl-6-chloro-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-(2-chloro-6-prop-2-enylphenoxy)ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-(2-chloro-6-prop-2-enylphenoxy)ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-(2-allyl-6-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=CC=C2Cl)CC=C

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCOC2=C(C=CC=C2Cl)CC=C

InChI

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