6-bromanyl-3-(4-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: 6-bromanyl-3-(4-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-(2-morpholin-4-ium-4-ylethyl)-2-oxo-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-[2-(4-morpholin-4-iumyl)ethyl]-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-(2-morpholin-4-ium-4-ylethyl)-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-N-(2-morpholin-4-ium-4-ylethyl)-1H-quinazoline-4-carboxamide Formula: C21H23BrClN4O4+ MolecularWeight: 510.78872

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C21H22BrClN4O4/c22-14-1-6-18-17(13-14)21(30,19(28)24-7-8-26-9-11-31-12-10-26)27(20(29)25-18)16-4-2-15(23)3-5-16/h1-6,13,30H,7-12H2,(H,24,28)(H,25,29)/p+1