butyl-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: butyl-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: butyl-[(2-chloro-6-fluoro-phenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: butyl-[(2-chloro-6-fluorophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: butyl-[(2-chloro-6-fluorophenyl)methyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: butyl-(2-chloro-6-fluoro-benzyl)-[(4-keto-1H-quinazolin-2-yl)methyl]ammonium Formula: C20H22ClFN3O+ MolecularWeight: 374.859583

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=C(C=CC=C1Cl)F)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC[NH+](CC1=C(C=CC=C1Cl)F)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H21ClFN3O/c1-2-3-11-25(12-15-16(21)8-6-9-17(15)22)13-19-23-18-10-5-4-7-14(18)20(26)24-19/h4-10H,2-3,11-13H2,1H3,(H,23,24,26)/p+1