tert-butyl 2,4-bis(oxidanylidene)-3-prop-2-enyl-pyrimidine-1-carboxylate

Systemtic Name: tert-butyl 2,4-bis(oxidanylidene)-3-prop-2-enyl-pyrimidine-1-carboxylate Openeye Name: tert-butyl 3-allyl-2,4-dioxo-pyrimidine-1-carboxylate CAS Name: 2,4-dioxo-3-prop-2-enyl-1-pyrimidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2,4-dioxo-3-prop-2-enylpyrimidine-1-carboxylate Traditional Name: 3-allyl-2,4-diketo-pyrimidine-1-carboxylic acid tert-butyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC(=O)N(C1=O)CC=C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC(=O)N(C1=O)CC=C

InChI

InChI=1S/C12H16N2O4/c1-5-7-13-9(15)6-8-14(10(13)16)11(17)18-12(2,3)4/h5-6,8H,1,7H2,2-4H3