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

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (2-chloro-4-fluoro-phenyl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (2-chloro-4-fluorophenyl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (2-chloro-4-fluorophenyl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (2-chloro-4-fluoro-benzyl)-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C17H16ClFN3O+ MolecularWeight: 332.779843

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=C(C=C1)F)Cl)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[NH+](CC1=C(C=C(C=C1)F)Cl)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H15ClFN3O/c1-22(9-11-6-7-12(19)8-14(11)18)10-16-20-15-5-3-2-4-13(15)17(23)21-16/h2-8H,9-10H2,1H3,(H,20,21,23)/p+1