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

Systemtic Name: 5-(1-ethylpiperidin-1-ium-1-yl)-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-ethylpiperidin-1-ium-1-yl)-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-ethyl-1-piperidin-1-iumyl)-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-ethylpiperidin-1-ium-1-yl)-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-ethylpiperidin-1-ium-1-yl)-5-phenyl-barbituric acid Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O3/c1-2-20(11-7-4-8-12-20)17(13-9-5-3-6-10-13)14(21)18-16(23)19-15(17)22/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3,(H-,18,19,21,22,23)/p+1