3-methylbutyl (E)-3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]prop-2-enoate

Systemtic Name: 3-methylbutyl (E)-3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]prop-2-enoate Openeye Name: isopentyl (E)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enoate CAS Name: (E)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (E)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enoate Traditional Name: (E)-3-(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)acrylic acid isoamyl ester Formula: C13H18N2O4 MolecularWeight: 266.29302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)C=CC(=O)OCCC(C)C

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)/C=C/C(=O)OCCC(C)C

InChI

InChI=1S/C13H18N2O4/c1-8(2)6-7-19-11(16)5-4-10-9(3)14-13(18)15-12(10)17/h4-5,8H,6-7H2,1-3H3,(H2,14,15,17,18)/b5-4+