[5-acetamido-6-(4-nitrophenoxy)-3-oxidanyl-4-(phenylcarbonyloxy)oxan-2-yl]methyl benzoate

Systemtic Name: [5-acetamido-6-(4-nitrophenoxy)-3-oxidanyl-4-(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [5-acetamido-4-benzoyloxy-3-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [5-acetamido-4-benzoyloxy-3-hydroxy-6-(4-nitrophenoxy)-2-oxanyl]methyl ester IUPAC Name: [5-acetamido-4-benzoyloxy-3-hydroxy-6-(4-nitrophenoxy)oxan-2-yl]methyl benzoate Traditional Name: benzoic acid [5-acetamido-4-benzoyloxy-3-hydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methyl ester Formula: C28H26N2O10 MolecularWeight: 550.51344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)[N+](=O)[O-])COC(=O)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1C(C(C(OC1OC2=CC=C(C=C2)[N+](=O)[O-])COC(=O)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26N2O10/c1-17(31)29-23-25(40-27(34)19-10-6-3-7-11-19)24(32)22(16-37-26(33)18-8-4-2-5-9-18)39-28(23)38-21-14-12-20(13-15-21)30(35)36/h2-15,22-25,28,32H,16H2,1H3,(H,29,31)