[6-methoxy-3-oxidanyl-4,5-bis(phenylcarbonyloxy)oxan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [6-methoxy-3-oxidanyl-4,5-bis(phenylcarbonyloxy)oxan-2-yl]methyl 4-nitrobenzoate Openeye Name: (4,5-dibenzoyloxy-3-hydroxy-6-methoxy-tetrahydropyran-2-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (4,5-dibenzoyloxy-3-hydroxy-6-methoxy-2-oxanyl)methyl ester IUPAC Name: (4,5-dibenzoyloxy-3-hydroxy-6-methoxyoxan-2-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4,5-dibenzoyloxy-3-hydroxy-6-methoxy-tetrahydropyran-2-yl)methyl ester Formula: C28H25NO11 MolecularWeight: 551.4982

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1C(C(C(C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H25NO11/c1-36-28-24(40-27(33)18-10-6-3-7-11-18)23(39-26(32)17-8-4-2-5-9-17)22(30)21(38-28)16-37-25(31)19-12-14-20(15-13-19)29(34)35/h2-15,21-24,28,30H,16H2,1H3