1-[(1R)-1-[1-[(4-fluorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(1R)-1-[1-[(4-fluorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(1R)-1-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(1R)-1-[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(1R)-1-[1-[(4-fluorophenyl)methyl]tetrazol-5-yl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(1R)-1-[1-(4-fluorobenzyl)tetrazol-5-yl]butyl]-4-(4-methoxyphenyl)piperazin-1-ium Formula: C23H30FN6O+ MolecularWeight: 425.522303

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=NN=NN1CC2=CC=C(C=C2)F)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC[C@H](C1=NN=NN1CC2=CC=C(C=C2)F)[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H29FN6O/c1-3-4-22(23-25-26-27-30(23)17-18-5-7-19(24)8-6-18)29-15-13-28(14-16-29)20-9-11-21(31-2)12-10-20/h5-12,22H,3-4,13-17H2,1-2H3/p+1/t22-/m1/s1