1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium

Systemtic Name: 1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium Openeye Name: 1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium CAS Name: 1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium IUPAC Name: 1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium Traditional Name: 1-(2-chlorophenyl)-4-[(2E)-3,7-dimethylocta-2,6-dienyl]piperazin-4-ium Formula: C20H30ClN2+ MolecularWeight: 333.9186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC[NH+]1CCN(CC1)C2=CC=CC=C2Cl)C)C

Isomeric SMILES

CC(=CCC/C(=C/C[NH+]1CCN(CC1)C2=CC=CC=C2Cl)/C)C

InChI

InChI=1S/C20H29ClN2/c1-17(2)7-6-8-18(3)11-12-22-13-15-23(16-14-22)20-10-5-4-9-19(20)21/h4-5,7,9-11H,6,8,12-16H2,1-3H3/p+1/b18-11+