6-fluoranyl-8-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]quinoline

Systemtic Name: 6-fluoranyl-8-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]quinoline Openeye Name: 8-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-fluoro-quinoline CAS Name: 6-fluoro-8-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]quinoline IUPAC Name: 8-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-fluoroquinoline Traditional Name: 8-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-fluoro-quinoline Formula: C21H23FN3+ MolecularWeight: 336.425823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C3C(=CC(=C2)F)C=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=C3C(=CC(=C2)F)C=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H22FN3/c22-20-13-18-7-4-8-23-21(18)19(14-20)16-25-11-9-24(10-12-25)15-17-5-2-1-3-6-17/h1-8,13-14H,9-12,15-16H2/p+1