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

Systemtic Name: 1-[3-(4-chloranyl-2-prop-2-enyl-phenoxy)propyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(2-allyl-4-chloro-phenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(4-chloro-2-prop-2-enylphenoxy)propyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(4-chloro-2-prop-2-enylphenoxy)propyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(2-allyl-4-chloro-phenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C17H26ClN2O+ MolecularWeight: 309.85414

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCOC2=C(C=C(C=C2)Cl)CC=C

Isomeric SMILES

C[NH+]1CCN(CC1)CCCOC2=C(C=C(C=C2)Cl)CC=C

InChI

InChI=1S/C17H25ClN2O/c1-3-5-15-14-16(18)6-7-17(15)21-13-4-8-20-11-9-19(2)10-12-20/h3,6-7,14H,1,4-5,8-13H2,2H3/p+1