[5-(4-benzamido-2-oxidanylidene-pyrimidin-1-yl)-3-(4-oxidanylidenepentanoyloxy)oxolan-2-yl]methyl 4-oxidanylidenepentanoate

Systemtic Name: [5-(4-benzamido-2-oxidanylidene-pyrimidin-1-yl)-3-(4-oxidanylidenepentanoyloxy)oxolan-2-yl]methyl 4-oxidanylidenepentanoate Openeye Name: [5-(4-benzamido-2-oxo-pyrimidin-1-yl)-3-(4-oxopentanoyloxy)tetrahydrofuran-2-yl]methyl 4-oxopentanoate CAS Name: 4-oxopentanoic acid [5-(4-benzamido-2-oxo-1-pyrimidinyl)-3-(1,4-dioxopentoxy)-2-oxolanyl]methyl ester IUPAC Name: [5-(4-benzamido-2-oxopyrimidin-1-yl)-3-(4-oxopentanoyloxy)oxolan-2-yl]methyl 4-oxopentanoate Traditional Name: 4-ketovaleric acid [5-(4-benzamido-2-keto-pyrimidin-1-yl)-3-(4-ketopentanoyloxy)tetrahydrofuran-2-yl]methyl ester Formula: C26H29N3O9 MolecularWeight: 527.52316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OCC1C(CC(O1)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3)OC(=O)CCC(=O)C

Isomeric SMILES

CC(=O)CCC(=O)OCC1C(CC(O1)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3)OC(=O)CCC(=O)C

InChI

InChI=1S/C26H29N3O9/c1-16(30)8-10-23(32)36-15-20-19(38-24(33)11-9-17(2)31)14-22(37-20)29-13-12-21(28-26(29)35)27-25(34)18-6-4-3-5-7-18/h3-7,12-13,19-20,22H,8-11,14-15H2,1-2H3,(H,27,28,34,35)