sodium 5-(2-cyclohexylethyl)-5-phenethyl-pyrimidin-3-ide-2,4,6-trione

Systemtic Name: sodium 5-(2-cyclohexylethyl)-5-phenethyl-pyrimidin-3-ide-2,4,6-trione Openeye Name: sodium 5-(2-cyclohexylethyl)-5-phenethyl-hexahydropyrimidin-3-ide-2,4,6-trione CAS Name: sodium 5-(2-cyclohexylethyl)-5-phenethylpyrimidin-3-ide-2,4,6-trione IUPAC Name: sodium 5-(2-cyclohexylethyl)-5-phenethylpyrimidin-3-ide-2,4,6-trione Traditional Name: sodium 5-(2-cyclohexylethyl)-5-phenethyl-hexahydropyrimidin-3-ide-2,4,6-trione Formula: C20H25N2NaO3 MolecularWeight: 364.41387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2(C(=O)NC(=O)[N-]C2=O)CCC3=CC=CC=C3.[Na+]

Isomeric SMILES

C1CCC(CC1)CCC2(C(=O)NC(=O)[N-]C2=O)CCC3=CC=CC=C3.[Na+]

InChI

InChI=1S/C20H26N2O3.Na/c23-17-20(18(24)22-19(25)21-17,13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16;/h1,3-4,7-8,16H,2,5-6,9-14H2,(H2,21,22,23,24,25);/q;+1/p-1