[2-azido-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(iodanylmethyl)oxolan-3-yl] 4-methoxybenzoate

Systemtic Name: [2-azido-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(iodanylmethyl)oxolan-3-yl] 4-methoxybenzoate Openeye Name: [2-azido-5-(2,4-dioxopyrimidin-1-yl)-2-(iodomethyl)tetrahydrofuran-3-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2-azido-5-(2,4-dioxo-1-pyrimidinyl)-2-(iodomethyl)-3-oxolanyl] ester IUPAC Name: [2-azido-5-(2,4-dioxopyrimidin-1-yl)-2-(iodomethyl)oxolan-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-azido-5-(2,4-diketopyrimidin-1-yl)-2-(iodomethyl)tetrahydrofuran-3-yl] ester Formula: C17H16IN5O6 MolecularWeight: 513.24331

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2CC(OC2(CI)N=[N+]=[N-])N3C=CC(=O)NC3=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2CC(OC2(CI)N=[N+]=[N-])N3C=CC(=O)NC3=O

InChI

InChI=1S/C17H16IN5O6/c1-27-11-4-2-10(3-5-11)15(25)28-12-8-14(29-17(12,9-18)21-22-19)23-7-6-13(24)20-16(23)26/h2-7,12,14H,8-9H2,1H3,(H,20,24,26)