5-(1-oxidanylpiperidin-1-ium-1-yl)-5-phenyl-1-propan-2-yl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1-oxidanylpiperidin-1-ium-1-yl)-5-phenyl-1-propan-2-yl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-1-isopropyl-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-hydroxy-1-piperidin-1-iumyl)-5-phenyl-1-propan-2-yl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-5-phenyl-1-propan-2-yl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-1-isopropyl-5-phenyl-barbituric acid Formula: C18H24N3O4+ MolecularWeight: 346.40086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(C(=O)NC1=O)(C2=CC=CC=C2)[N+]3(CCCCC3)O

Isomeric SMILES

CC(C)N1C(=O)C(C(=O)NC1=O)(C2=CC=CC=C2)[N+]3(CCCCC3)O

InChI

InChI=1S/C18H23N3O4/c1-13(2)20-16(23)18(15(22)19-17(20)24,14-9-5-3-6-10-14)21(25)11-7-4-8-12-21/h3,5-6,9-10,13,25H,4,7-8,11-12H2,1-2H3/p+1