3-[[6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-dimethylazanium Traditional Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carbonyl]amino]propyl-dimethyl-ammonium Formula: C20H23BrClN4O3+ MolecularWeight: 482.77862

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)Cl)O

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H22BrClN4O3/c1-25(2)11-3-10-23-18(27)20(29)16-12-13(21)4-9-17(16)24-19(28)26(20)15-7-5-14(22)6-8-15/h4-9,12,29H,3,10-11H2,1-2H3,(H,23,27)(H,24,28)/p+1