1-[3-(2-chloranyl-6-prop-2-enyl-phenoxy)propyl]piperazine-1,4-diium

Systemtic Name: 1-[3-(2-chloranyl-6-prop-2-enyl-phenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-[3-(2-allyl-6-chloro-phenoxy)propyl]piperazine-1,4-diium CAS Name: 1-[3-(2-chloro-6-prop-2-enylphenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-[3-(2-chloro-6-prop-2-enylphenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-[3-(2-allyl-6-chloro-phenoxy)propyl]piperazine-1,4-diium Formula: C16H25ClN2O+2 MolecularWeight: 296.8355

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C(=CC=C1)Cl)OCCC[NH+]2CC[NH2+]CC2

Isomeric SMILES

C=CCC1=C(C(=CC=C1)Cl)OCCC[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C16H23ClN2O/c1-2-5-14-6-3-7-15(17)16(14)20-13-4-10-19-11-8-18-9-12-19/h2-3,6-7,18H,1,4-5,8-13H2/p+2