butanoic acid; 5-butyl-1-(4-oxidanylcyclohexyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: butanoic acid; 5-butyl-1-(4-oxidanylcyclohexyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-butyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione; butyric acid CAS Name: butanoic acid; 5-butyl-1-(4-hydroxycyclohexyl)-1,3-diazinane-2,4,6-trione IUPAC Name: butanoic acid; 5-butyl-1-(4-hydroxycyclohexyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-butyl-1-(4-hydroxycyclohexyl)barbituric acid; butyric acid Formula: C18H30N2O6 MolecularWeight: 370.4406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)NC(=O)N(C1=O)C2CCC(CC2)O.CCCC(=O)O

Isomeric SMILES

CCCCC1C(=O)NC(=O)N(C1=O)C2CCC(CC2)O.CCCC(=O)O

InChI

InChI=1S/C14H22N2O4.C4H8O2/c1-2-3-4-11-12(18)15-14(20)16(13(11)19)9-5-7-10(17)8-6-9;1-2-3-4(5)6/h9-11,17H,2-8H2,1H3,(H,15,18,20);2-3H2,1H3,(H,5,6)