3-methylbutyl (E)-3-[2,4-bis(oxidanylidene)-1,3-diazinan-5-yl]prop-2-enoate

Systemtic Name: 3-methylbutyl (E)-3-[2,4-bis(oxidanylidene)-1,3-diazinan-5-yl]prop-2-enoate Openeye Name: isopentyl (E)-3-(2,4-dioxohexahydropyrimidin-5-yl)prop-2-enoate CAS Name: (E)-3-(2,4-dioxo-1,3-diazinan-5-yl)-2-propenoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (E)-3-(2,4-dioxo-1,3-diazinan-5-yl)prop-2-enoate Traditional Name: (E)-3-(2,4-diketohexahydropyrimidin-5-yl)acrylic acid isoamyl ester Formula: C12H18N2O4 MolecularWeight: 254.28232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C=CC1CNC(=O)NC1=O

Isomeric SMILES

CC(C)CCOC(=O)/C=C/C1CNC(=O)NC1=O

InChI

InChI=1S/C12H18N2O4/c1-8(2)5-6-18-10(15)4-3-9-7-13-12(17)14-11(9)16/h3-4,8-9H,5-7H2,1-2H3,(H2,13,14,16,17)/b4-3+