[4-azidooxy-5-chloranyl-2-(phenylcarbonyloxymethyl)oxolan-3-yl] 4-nitrobenzoate

Systemtic Name: [4-azidooxy-5-chloranyl-2-(phenylcarbonyloxymethyl)oxolan-3-yl] 4-nitrobenzoate Openeye Name: [4-azidooxy-2-(benzoyloxymethyl)-5-chloro-tetrahydrofuran-3-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-azidooxy-2-(benzoyloxymethyl)-5-chloro-3-oxolanyl] ester IUPAC Name: [4-azidooxy-2-(benzoyloxymethyl)-5-chlorooxolan-3-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-azidooxy-2-(benzoyloxymethyl)-5-chloro-tetrahydrofuran-3-yl] ester Formula: C19H15ClN4O8 MolecularWeight: 462.7974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)Cl)ON=[N+]=[N-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)Cl)ON=[N+]=[N-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN4O8/c20-17-16(32-23-22-21)15(31-19(26)12-6-8-13(9-7-12)24(27)28)14(30-17)10-29-18(25)11-4-2-1-3-5-11/h1-9,14-17H,10H2