1-(3-fluoranyl-4-methyl-phenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium CAS Name: 1-(3-fluoro-4-methylphenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium IUPAC Name: 1-(3-fluoro-4-methylphenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Formula: C22H30FN2O3+ MolecularWeight: 389.483603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC[NH+](CC2)CCC3=CC(=C(C(=C3)OC)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC[NH+](CC2)CCC3=CC(=C(C(=C3)OC)OC)OC)F

InChI

InChI=1S/C22H29FN2O3/c1-16-5-6-18(15-19(16)23)25-11-9-24(10-12-25)8-7-17-13-20(26-2)22(28-4)21(14-17)27-3/h5-6,13-15H,7-12H2,1-4H3/p+1