3-azido-6-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-4,5-bis(phenylcarbonyloxy)oxane-2-carboxylic acid

Systemtic Name: 3-azido-6-[5-bromanyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-4,5-bis(phenylcarbonyloxy)oxane-2-carboxylic acid Openeye Name: 3-azido-4,5-dibenzoyloxy-6-(5-bromo-2,4-dioxo-pyrimidin-1-yl)tetrahydropyran-2-carboxylic acid CAS Name: 3-azido-4,5-dibenzoyloxy-6-(5-bromo-2,4-dioxo-1-pyrimidinyl)-2-oxanecarboxylic acid IUPAC Name: 3-azido-4,5-dibenzoyloxy-6-(5-bromo-2,4-dioxopyrimidin-1-yl)oxane-2-carboxylic acid Traditional Name: 3-azido-4,5-dibenzoyloxy-6-(5-bromo-2,4-diketo-pyrimidin-1-yl)tetrahydropyran-2-carboxylic acid Formula: C24H18BrN5O9 MolecularWeight: 600.33182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C(C(OC(C2OC(=O)C3=CC=CC=C3)N4C=C(C(=O)NC4=O)Br)C(=O)O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2C(C(OC(C2OC(=O)C3=CC=CC=C3)N4C=C(C(=O)NC4=O)Br)C(=O)O)N=[N+]=[N-]

InChI

InChI=1S/C24H18BrN5O9/c25-14-11-30(24(36)27-19(14)31)20-18(39-23(35)13-9-5-2-6-10-13)16(15(28-29-26)17(37-20)21(32)33)38-22(34)12-7-3-1-4-8-12/h1-11,15-18,20H,(H,32,33)(H,27,31,36)