[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-methylpyrazin-2-yl)methanone

Systemtic Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-methylpyrazin-2-yl)methanone Openeye Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-methylpyrazin-2-yl)methanone CAS Name: [4-[bis(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-(5-methyl-2-pyrazinyl)methanone IUPAC Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-methylpyrazin-2-yl)methanone Traditional Name: [4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-(5-methylpyrazin-2-yl)methanone Formula: C23H23F2N4O+ MolecularWeight: 409.451726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CC[NH+](CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CC[NH+](CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22F2N4O/c1-16-14-27-21(15-26-16)23(30)29-12-10-28(11-13-29)22(17-2-6-19(24)7-3-17)18-4-8-20(25)9-5-18/h2-9,14-15,22H,10-13H2,1H3/p+1