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

Systemtic Name: [2-azido-2-(iodanylmethyl)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl] 4-methoxybenzoate Openeye Name: [2-azido-2-(iodomethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2-azido-2-(iodomethyl)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl] ester IUPAC Name: [2-azido-2-(iodomethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-azido-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2-(iodomethyl)tetrahydrofuran-3-yl] ester Formula: C18H18IN5O6 MolecularWeight: 527.26989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)(CI)N=[N+]=[N-])OC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)(CI)N=[N+]=[N-])OC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18IN5O6/c1-10-8-24(17(27)21-15(10)25)14-7-13(18(9-19,30-14)22-23-20)29-16(26)11-3-5-12(28-2)6-4-11/h3-6,8,13-14H,7,9H2,1-2H3,(H,21,25,27)