[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-ethynyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-3-yl] ethanoate

Systemtic Name: [2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-ethynyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-3-yl] ethanoate Openeye Name: [4-benzyloxy-5-(benzyloxymethyl)-2-(2,4-dioxopyrimidin-1-yl)-5-ethynyl-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [2-(2,4-dioxo-1-pyrimidinyl)-5-ethynyl-4-phenylmethoxy-5-(phenylmethoxymethyl)-3-oxolanyl] ester IUPAC Name: [2-(2,4-dioxopyrimidin-1-yl)-5-ethynyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-3-yl] acetate Traditional Name: acetic acid [4-benzoxy-5-(benzoxymethyl)-2-(2,4-diketopyrimidin-1-yl)-5-ethynyl-tetrahydrofuran-3-yl] ester Formula: C27H26N2O7 MolecularWeight: 490.50454

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC1N2C=CC(=O)NC2=O)(COCC3=CC=CC=C3)C#C)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1C(C(OC1N2C=CC(=O)NC2=O)(COCC3=CC=CC=C3)C#C)OCC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O7/c1-3-27(18-33-16-20-10-6-4-7-11-20)24(34-17-21-12-8-5-9-13-21)23(35-19(2)30)25(36-27)29-15-14-22(31)28-26(29)32/h1,4-15,23-25H,16-18H2,2H3,(H,28,31,32)