[(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-(2,2-dimethylpropanoyloxy)oxolan-3-yl] 2,2-dimethylpropanoate

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$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-4-(2,2-dimethylpropanoyloxy)oxolan-3-yl] 2,2-dimethylpropanoate Openeye Name: [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-4-(2,2-dimethylpropanoyloxy)-2-(2,4-dioxopyrimidin-1-yl)tetrahydrofuran-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphorinan-2-yl]oxymethyl]-4-(2,2-dimethyl-1-oxopropoxy)-2-(2,4-dioxo-1-pyrimidinyl)-3-oxolanyl] ester IUPAC Name: [(2R,3R,4S,5R)-5-azido-5-[[(4S)-4-(3-chlorophenyl)-2-oxo-1,3,2$l^{5}-dioxaphosphinan-2-yl]oxymethyl]-4-(2,2-dimethylpropanoyloxy)-2-(2,4-dioxopyrimidin-1-yl)oxolan-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic 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-pivaloyloxy-tetrahydrofuran-3-yl] ester Formula: C28H35ClN5O11P MolecularWeight: 684.031161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1C(C(OC1N2C=CC(=O)NC2=O)(COP3(=O)OCCC(O3)C4=CC(=CC=C4)Cl)N=[N+]=[N-])OC(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)O[C@@H]1[C@@H]([C@](O[C@H]1N2C=CC(=O)NC2=O)(COP3(=O)OCC[C@H](O3)C4=CC(=CC=C4)Cl)N=[N+]=[N-])OC(=O)C(C)(C)C

InChI

InChI=1S/C28H35ClN5O11P/c1-26(2,3)23(36)42-20-21(43-24(37)27(4,5)6)28(32-33-30,44-22(20)34-12-10-19(35)31-25(34)38)15-41-46(39)40-13-11-18(45-46)16-8-7-9-17(29)14-16/h7-10,12,14,18,20-22H,11,13,15H2,1-6H3,(H,31,35,38)/t18-,20+,21-,22+,28+,46?/m0/s1