[(1R)-1-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-ethyl-azanium

Systemtic Name: [(1R)-1-[3-(3-chloranyl-4-fluoranyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-ethyl-azanium Openeye Name: [(1R)-1-[3-(3-chloro-4-fluoro-phenyl)-4-oxo-quinazolin-2-yl]propyl]-ethyl-ammonium CAS Name: [(1R)-1-[3-(3-chloro-4-fluorophenyl)-4-oxo-2-quinazolinyl]propyl]-ethylammonium IUPAC Name: [(1R)-1-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-ethylazanium Traditional Name: [(1R)-1-[3-(3-chloro-4-fluoro-phenyl)-4-keto-quinazolin-2-yl]propyl]-ethyl-ammonium Formula: C19H20ClFN3O+ MolecularWeight: 360.833003

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)Cl)[NH2+]CC

Isomeric SMILES

CC[C@H](C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)Cl)[NH2+]CC

InChI

InChI=1S/C19H19ClFN3O/c1-3-16(22-4-2)18-23-17-8-6-5-7-13(17)19(25)24(18)12-9-10-15(21)14(20)11-12/h5-11,16,22H,3-4H2,1-2H3/p+1/t16-/m1/s1