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

Systemtic Name: 6-bromanyl-3-(4-chlorophenyl)-4-oxidanyl-2-oxidanylidene-N-(3-piperidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-N-(3-piperidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-N-[3-(1-piperidin-1-iumyl)propyl]-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-oxo-N-(3-piperidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-N-(3-piperidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Formula: C23H27BrClN4O3+ MolecularWeight: 522.84248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C23H26BrClN4O3/c24-16-5-10-20-19(15-16)23(32,21(30)26-11-4-14-28-12-2-1-3-13-28)29(22(31)27-20)18-8-6-17(25)7-9-18/h5-10,15,32H,1-4,11-14H2,(H,26,30)(H,27,31)/p+1