3-[[3-(3,4-dichlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[3-(3,4-dichlorophenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazolin-4-yl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazolin-4-yl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carbonyl]amino]propyl-diethylazanium Traditional Name: 3-[[3-(3,4-dichlorophenyl)-4-hydroxy-2-keto-1H-quinazoline-4-carbonyl]amino]propyl-diethyl-ammonium Formula: C22H27Cl2N4O3+ MolecularWeight: 466.38078

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC(=C(C=C3)Cl)Cl)O

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1(C2=CC=CC=C2NC(=O)N1C3=CC(=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C22H26Cl2N4O3/c1-3-27(4-2)13-7-12-25-20(29)22(31)16-8-5-6-9-19(16)26-21(30)28(22)15-10-11-17(23)18(24)14-15/h5-6,8-11,14,31H,3-4,7,12-13H2,1-2H3,(H,25,29)(H,26,30)/p+1