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

Systemtic Name: 1-methyl-5-(1-oxidanylpiperidin-1-ium-1-yl)-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-1-methyl-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-hydroxy-1-piperidin-1-iumyl)-1-methyl-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-1-methyl-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-hydroxypiperidin-1-ium-1-yl)-1-methyl-5-phenyl-barbituric acid Formula: C16H20N3O4+ MolecularWeight: 318.3477

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)NC1=O)(C2=CC=CC=C2)[N+]3(CCCCC3)O

Isomeric SMILES

CN1C(=O)C(C(=O)NC1=O)(C2=CC=CC=C2)[N+]3(CCCCC3)O

InChI

InChI=1S/C16H19N3O4/c1-18-14(21)16(13(20)17-15(18)22,12-8-4-2-5-9-12)19(23)10-6-3-7-11-19/h2,4-5,8-9,23H,3,6-7,10-11H2,1H3/p+1