3-(3-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 4-hydroxy-3-(3-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-2-oxo-1H-quinazoline-4-carboxamide CAS Name: 4-hydroxy-3-(3-methoxyphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 4-hydroxy-3-(3-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 4-hydroxy-2-keto-3-(3-methoxyphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1H-quinazoline-4-carboxamide Formula: C23H29N4O5+ MolecularWeight: 441.50016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)NCCC[NH+]4CCOCC4)O

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)NCCC[NH+]4CCOCC4)O

InChI

InChI=1S/C23H28N4O5/c1-31-18-7-4-6-17(16-18)27-22(29)25-20-9-3-2-8-19(20)23(27,30)21(28)24-10-5-11-26-12-14-32-15-13-26/h2-4,6-9,16,30H,5,10-15H2,1H3,(H,24,28)(H,25,29)/p+1