sodium 3-but-3-en-2-yl-1-(3-chlorophenyl)-5-ethanoyl-2,6-bis(oxidanylidene)pyrimidin-4-olate

Systemtic Name: sodium 3-but-3-en-2-yl-1-(3-chlorophenyl)-5-ethanoyl-2,6-bis(oxidanylidene)pyrimidin-4-olate Openeye Name: sodium 5-acetyl-1-(3-chlorophenyl)-3-(1-methylallyl)-2,6-dioxo-pyrimidin-4-olate CAS Name: sodium 5-acetyl-3-but-3-en-2-yl-1-(3-chlorophenyl)-2,6-dioxo-4-pyrimidinolate IUPAC Name: sodium 5-acetyl-3-but-3-en-2-yl-1-(3-chlorophenyl)-2,6-dioxopyrimidin-4-olate Traditional Name: sodium 5-acetyl-1-(3-chlorophenyl)-2,6-diketo-3-(1-methylallyl)pyrimidin-4-olate Formula: C16H14ClN2NaO4 MolecularWeight: 356.73613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)N1C(=C(C(=O)N(C1=O)C2=CC(=CC=C2)Cl)C(=O)C)[O-].[Na+]

Isomeric SMILES

CC(C=C)N1C(=C(C(=O)N(C1=O)C2=CC(=CC=C2)Cl)C(=O)C)[O-].[Na+]

InChI

InChI=1S/C16H15ClN2O4.Na/c1-4-9(2)18-14(21)13(10(3)20)15(22)19(16(18)23)12-7-5-6-11(17)8-12;/h4-9,21H,1H2,2-3H3;/q;+1/p-1