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

Systemtic Name: 5-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-methyl-1-piperidin-1-iumyl)-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-methylpiperidin-1-ium-1-yl)-5-phenyl-barbituric acid Formula: C16H20N3O3+ MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)C2(C(=O)NC(=O)NC2=O)C3=CC=CC=C3

Isomeric SMILES

C[N+]1(CCCCC1)C2(C(=O)NC(=O)NC2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3O3/c1-19(10-6-3-7-11-19)16(12-8-4-2-5-9-12)13(20)17-15(22)18-14(16)21/h2,4-5,8-9H,3,6-7,10-11H2,1H3,(H-,17,18,20,21,22)/p+1