[(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl benzoate

Systemtic Name: [(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl benzoate Openeye Name: [(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3S,5R)-3-(8-azidooctoxymethoxy)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C26H35N5O7 MolecularWeight: 529.5854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(=O)C3=CC=CC=C3)OCOCCCCCCCCN=[N+]=[N-]

InChI

InChI=1S/C26H35N5O7/c1-19-16-31(26(34)29-24(19)32)23-15-21(22(38-23)17-36-25(33)20-11-7-6-8-12-20)37-18-35-14-10-5-3-2-4-9-13-28-30-27/h6-8,11-12,16,21-23H,2-5,9-10,13-15,17-18H2,1H3,(H,29,32,34)/t21-,22+,23+/m0/s1