5-methyl-5-(4-pyridin-4-ylphenoxy)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-methyl-5-(4-pyridin-4-ylphenoxy)-1,3-diazinane-2,4,6-trione Openeye Name: 5-methyl-5-[4-(4-pyridyl)phenoxy]hexahydropyrimidine-2,4,6-trione CAS Name: 5-methyl-5-(4-pyridin-4-ylphenoxy)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-methyl-5-(4-pyridin-4-ylphenoxy)-1,3-diazinane-2,4,6-trione Traditional Name: 5-methyl-5-[4-(4-pyridyl)phenoxy]barbituric acid Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC(=O)NC1=O)OC2=CC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

CC1(C(=O)NC(=O)NC1=O)OC2=CC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C16H13N3O4/c1-16(13(20)18-15(22)19-14(16)21)23-12-4-2-10(3-5-12)11-6-8-17-9-7-11/h2-9H,1H3,(H2,18,19,20,21,22)