[4-[5-ethenyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylcarbonyloxymethyl)butyl] benzoate

Systemtic Name: [4-[5-ethenyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(phenylcarbonyloxymethyl)butyl] benzoate Openeye Name: [2-(benzoyloxymethyl)-4-(2,4-dioxo-5-vinyl-pyrimidin-1-yl)butyl] benzoate CAS Name: benzoic acid [2-(benzoyloxymethyl)-4-(5-ethenyl-2,4-dioxo-1-pyrimidinyl)butyl] ester IUPAC Name: [2-(benzoyloxymethyl)-4-(5-ethenyl-2,4-dioxopyrimidin-1-yl)butyl] benzoate Traditional Name: benzoic acid [2-(benzoyloxymethyl)-4-(2,4-diketo-5-vinyl-pyrimidin-1-yl)butyl] ester Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CN(C(=O)NC1=O)CCC(COC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3

Isomeric SMILES

C=CC1=CN(C(=O)NC1=O)CCC(COC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H24N2O6/c1-2-19-15-27(25(31)26-22(19)28)14-13-18(16-32-23(29)20-9-5-3-6-10-20)17-33-24(30)21-11-7-4-8-12-21/h2-12,15,18H,1,13-14,16-17H2,(H,26,28,31)