[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-4-prop-2-enoxy-oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-4-prop-2-enoxy-oxolan-2-yl]methyl benzoate Openeye Name: [4-allyloxy-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-4-prop-2-enoxy-2-oxolanyl]methyl ester IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxy-4-prop-2-enoxyoxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [4-allyloxy-5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1C(C(OC1N2C=CC(=NC2=O)N)COC(=O)C3=CC=CC=C3)O

Isomeric SMILES

C=CCOC1C(C(OC1N2C=CC(=NC2=O)N)COC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C19H21N3O6/c1-2-10-26-16-15(23)13(11-27-18(24)12-6-4-3-5-7-12)28-17(16)22-9-8-14(20)21-19(22)25/h2-9,13,15-17,23H,1,10-11H2,(H2,20,21,25)