5-heptyl-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-heptyl-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-heptyl-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-heptyl-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-heptyl-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-heptyl-1-phenyl-barbituric acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O3/c1-2-3-4-5-9-12-14-15(20)18-17(22)19(16(14)21)13-10-7-6-8-11-13/h6-8,10-11,14H,2-5,9,12H2,1H3,(H,18,20,22)