[(2S,4S)-4-[5-methyl-2,4-bis(oxidanylidene)-3-(phenylcarbonyl)pyrimidin-1-yl]oxolan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [(2S,4S)-4-[5-methyl-2,4-bis(oxidanylidene)-3-(phenylcarbonyl)pyrimidin-1-yl]oxolan-2-yl]methyl 4-nitrobenzoate Openeye Name: [(2S,4S)-4-(3-benzoyl-5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,4S)-4-(3-benzoyl-5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl ester IUPAC Name: [(2S,4S)-4-(3-benzoyl-5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S,4S)-4-(3-benzoyl-2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C24H21N3O8 MolecularWeight: 479.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)C3CC(OC3)COC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CN(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)[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(31)26(21(15)28)22(29)16-5-3-2-4-6-16)19-11-20(34-13-19)14-35-23(30)17-7-9-18(10-8-17)27(32)33/h2-10,12,19-20H,11,13-14H2,1H3/t19-,20-/m0/s1