1-[3-(2-chloranyl-6-prop-2-enyl-phenoxy)propyl]piperazin-4-ium

Systemtic Name: 1-[3-(2-chloranyl-6-prop-2-enyl-phenoxy)propyl]piperazin-4-ium Openeye Name: 1-[3-(2-allyl-6-chloro-phenoxy)propyl]piperazin-4-ium CAS Name: 1-[3-(2-chloro-6-prop-2-enylphenoxy)propyl]piperazin-4-ium IUPAC Name: 1-[3-(2-chloro-6-prop-2-enylphenoxy)propyl]piperazin-4-ium Traditional Name: 1-[3-(2-allyl-6-chloro-phenoxy)propyl]piperazin-4-ium Formula: C16H24ClN2O+ MolecularWeight: 295.82756

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C(=CC=C1)Cl)OCCCN2CC[NH2+]CC2

Isomeric SMILES

C=CCC1=C(C(=CC=C1)Cl)OCCCN2CC[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+1