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

Systemtic Name: 3-[[6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-diethylazanium Traditional Name: 3-[[6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carbonyl]amino]propyl-diethyl-ammonium Formula: C22H27BrClN4O3+ MolecularWeight: 510.83178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26BrClN4O3/c1-3-27(4-2)13-5-12-25-20(29)22(31)18-14-15(23)6-11-19(18)26-21(30)28(22)17-9-7-16(24)8-10-17/h6-11,14,31H,3-5,12-13H2,1-2H3,(H,25,29)(H,26,30)/p+1