4-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-(4-amino-2-oxo-pyrimidin-1-yl)-2-(benzyloxymethyl)tetrahydrofuran-3-yl]oxy-4-oxo-butanoic acid CAS Name: 4-[[5-(4-amino-2-oxo-1-pyrimidinyl)-2-(phenylmethoxymethyl)-3-oxolanyl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[5-(4-amino-2-oxopyrimidin-1-yl)-2-(phenylmethoxymethyl)oxolan-3-yl]oxy-4-oxobutanoic acid Traditional Name: 4-[5-(4-amino-2-keto-pyrimidin-1-yl)-2-(benzoxymethyl)tetrahydrofuran-3-yl]oxy-4-keto-butyric acid Formula: C20H23N3O7 MolecularWeight: 417.41252

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)COCC3=CC=CC=C3)OC(=O)CCC(=O)O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)COCC3=CC=CC=C3)OC(=O)CCC(=O)O

InChI

InChI=1S/C20H23N3O7/c21-16-8-9-23(20(27)22-16)17-10-14(30-19(26)7-6-18(24)25)15(29-17)12-28-11-13-4-2-1-3-5-13/h1-5,8-9,14-15,17H,6-7,10-12H2,(H,24,25)(H2,21,22,27)