[2-acetyloxy-3-(4-nitrophenyl)carbonyloxy-5-(phenylcarbonyloxy)oxan-4-yl] 4-nitrobenzoate

Systemtic Name: [2-acetyloxy-3-(4-nitrophenyl)carbonyloxy-5-(phenylcarbonyloxy)oxan-4-yl] 4-nitrobenzoate Openeye Name: [2-acetoxy-5-benzoyloxy-3-(4-nitrobenzoyl)oxy-tetrahydropyran-4-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-acetyloxy-5-benzoyloxy-3-[(4-nitrophenyl)-oxomethoxy]-4-oxanyl] ester IUPAC Name: [2-acetyloxy-5-benzoyloxy-3-(4-nitrobenzoyl)oxyoxan-4-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-acetoxy-5-benzoyloxy-3-(4-nitrobenzoyl)oxy-tetrahydropyran-4-yl] ester Formula: C28H22N2O13 MolecularWeight: 594.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(CO1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1C(C(C(CO1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H22N2O13/c1-16(31)40-28-24(43-27(34)19-9-13-21(14-10-19)30(37)38)23(42-26(33)18-7-11-20(12-8-18)29(35)36)22(15-39-28)41-25(32)17-5-3-2-4-6-17/h2-14,22-24,28H,15H2,1H3