5-(2-methylidene-6-oxidanyl-heptyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(2-methylidene-6-oxidanyl-heptyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(6-hydroxy-2-methylene-heptyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(6-hydroxy-2-methyleneheptyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(6-hydroxy-2-methylideneheptyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[2-(4-hydroxypentyl)allyl]barbituric acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(=C)CC1C(=O)NC(=O)NC1=O)O

Isomeric SMILES

CC(CCCC(=C)CC1C(=O)NC(=O)NC1=O)O

InChI

InChI=1S/C12H18N2O4/c1-7(4-3-5-8(2)15)6-9-10(16)13-12(18)14-11(9)17/h8-9,15H,1,3-6H2,2H3,(H2,13,14,16,17,18)