[(2R,3R,4S,5R)-5-azido-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-[[(4S)-4-(3-chlorophenyl)-2-oxidanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-4-(1H-pyrazol-5-ylcarbonyloxy)oxolan-3-yl] 1H-pyrazole-5-carboxylate

Systemtic Name: [(2R,3R,4S,5R)-5-azido-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-[[(4S)-4-(3-chlorophenyl)-2-oxidanylidene-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-4-(1H-pyrazol-5-ylcarbonyloxy)oxolan-3-yl] 1H-pyrazole-5-carboxylate Openeye Name: [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-(1H-pyrazole-5-carbonyloxy)tetrahydrofuran-3-yl] 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphorinan-2-yl]oxymethyl]-2-(2,4-dioxo-1-pyrimidinyl)-4-[oxo(1H-pyrazol-5-yl)methoxy]-3-oxolanyl] ester IUPAC Name: [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-(1H-pyrazole-5-carbonyloxy)oxolan-3-yl] 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-keto-1,3,2$l^{5}-dioxaphosphorinan-2-yl]oxymethyl]-2-(2,4-diketopyrimidin-1-yl)-4-(1H-pyrazole-5-carbonyloxy)tetrahydrofuran-3-yl] ester Formula: C26H23ClN9O11P MolecularWeight: 703.941281

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Descriptors Computed from Structure

Canonical SMILES:

C1COP(=O)(OC1C2=CC(=CC=C2)Cl)OCC3(C(C(C(O3)N4C=CC(=O)NC4=O)OC(=O)C5=CC=NN5)OC(=O)C6=CC=NN6)N=[N+]=[N-]

Isomeric SMILES

C1COP(=O)(O[C@@H]1C2=CC(=CC=C2)Cl)OC[C@@]3([C@H]([C@H]([C@@H](O3)N4C=CC(=O)NC4=O)OC(=O)C5=CC=NN5)OC(=O)C6=CC=NN6)N=[N+]=[N-]

InChI

InChI=1S/C26H23ClN9O11P/c27-15-3-1-2-14(12-15)18-7-11-42-48(41,47-18)43-13-26(34-35-28)21(45-24(39)17-5-9-30-33-17)20(44-23(38)16-4-8-29-32-16)22(46-26)36-10-6-19(37)31-25(36)40/h1-6,8-10,12,18,20-22H,7,11,13H2,(H,29,32)(H,30,33)(H,31,37,40)/t18-,20+,21-,22+,26+,48?/m0/s1