[(2S,4S)-4-[5-methyl-6-oxidanylidene-1-(phenylcarbonyl)pyrimidin-2-yl]oxyoxolan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [(2S,4S)-4-[5-methyl-6-oxidanylidene-1-(phenylcarbonyl)pyrimidin-2-yl]oxyoxolan-2-yl]methyl 4-nitrobenzoate Openeye Name: [(2S,4S)-4-(1-benzoyl-5-methyl-6-oxo-pyrimidin-2-yl)oxytetrahydrofuran-2-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,4S)-4-[(1-benzoyl-5-methyl-6-oxo-2-pyrimidinyl)oxy]-2-oxolanyl]methyl ester IUPAC Name: [(2S,4S)-4-(1-benzoyl-5-methyl-6-oxopyrimidin-2-yl)oxyoxolan-2-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S,4S)-4-(1-benzoyl-6-keto-5-methyl-pyrimidin-2-yl)oxytetrahydrofuran-2-yl]methyl ester Formula: C24H21N3O8 MolecularWeight: 479.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N(C1=O)C(=O)C2=CC=CC=C2)OC3CC(OC3)COC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(N(C1=O)C(=O)C2=CC=CC=C2)O[C@H]3C[C@H](OC3)COC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O8/c1-15-12-25-24(26(21(15)28)22(29)16-5-3-2-4-6-16)35-20-11-19(33-14-20)13-34-23(30)17-7-9-18(10-8-17)27(31)32/h2-10,12,19-20H,11,13-14H2,1H3/t19-,20-/m0/s1