2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-(2,6-dimethyl-5-nitro-pyrimidin-4-yl)oxy-3-oxidanylidene-cyclopentyl]ethyl 2,2-dimethylpropanoate

Systemtic Name: 2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-(2,6-dimethyl-5-nitro-pyrimidin-4-yl)oxy-3-oxidanylidene-cyclopentyl]ethyl 2,2-dimethylpropanoate Openeye Name: 2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-(2,6-dimethyl-5-nitro-pyrimidin-4-yl)oxy-3-oxo-cyclopentyl]ethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-[(2,6-dimethyl-5-nitro-4-pyrimidinyl)oxy]-3-oxocyclopentyl]ethyl ester IUPAC Name: 2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-(2,6-dimethyl-5-nitropyrimidin-4-yl)oxy-3-oxocyclopentyl]ethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 2-[(1R,2R,4S)-4-[3-[tert-butyl(diphenyl)silyl]oxypropyl]-2-(2,6-dimethyl-5-nitro-pyrimidin-4-yl)oxy-3-keto-cyclopentyl]ethyl ester Formula: C37H49N3O7Si MolecularWeight: 675.88636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)OC2C(CC(C2=O)CCCO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)CCOC(=O)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)C)O[C@@H]2[C@H](C[C@@H](C2=O)CCCO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)CCOC(=O)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C37H49N3O7Si/c1-25-31(40(43)44)34(39-26(2)38-25)47-33-28(21-23-45-35(42)36(3,4)5)24-27(32(33)41)16-15-22-46-48(37(6,7)8,29-17-11-9-12-18-29)30-19-13-10-14-20-30/h9-14,17-20,27-28,33H,15-16,21-24H2,1-8H3/t27-,28-,33+/m0/s1