1-[4-(2-adamantyl)phenyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-[4-(2-adamantyl)phenyl]-1,3-diazinane-2,4,6-trione Openeye Name: 1-[4-(2-adamantyl)phenyl]hexahydropyrimidine-2,4,6-trione CAS Name: 1-[4-(2-adamantyl)phenyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-[4-(2-adamantyl)phenyl]-1,3-diazinane-2,4,6-trione Traditional Name: 1-[4-(2-adamantyl)phenyl]barbituric acid Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=CC=C(C=C4)N5C(=O)CC(=O)NC5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=CC=C(C=C4)N5C(=O)CC(=O)NC5=O

InChI

InChI=1S/C20H22N2O3/c23-17-10-18(24)22(20(25)21-17)16-3-1-13(2-4-16)19-14-6-11-5-12(8-14)9-15(19)7-11/h1-4,11-12,14-15,19H,5-10H2,(H,21,23,25)