6,8-bis(bromanyl)-2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C19H18Br2FN4O+ MolecularWeight: 497.178823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br)C4=CC=CC=C4F

InChI

InChI=1S/C19H17Br2FN4O/c20-12-9-13-18(14(21)10-12)23-17(24-19(13)27)11-25-5-7-26(8-6-25)16-4-2-1-3-15(16)22/h1-4,9-10H,5-8,11H2,(H,23,24,27)/p+1