[2-(4-nitrophenyl)-1,3-dioxan-5-yl] 4-bromanylbenzoate

Systemtic Name: [2-(4-nitrophenyl)-1,3-dioxan-5-yl] 4-bromanylbenzoate Openeye Name: [2-(4-nitrophenyl)-1,3-dioxan-5-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(4-nitrophenyl)-1,3-dioxan-5-yl] ester IUPAC Name: [2-(4-nitrophenyl)-1,3-dioxan-5-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(4-nitrophenyl)-1,3-dioxan-5-yl] ester Formula: C17H14BrNO6 MolecularWeight: 408.20016

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1C(COC(O1)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrNO6/c18-13-5-1-11(2-6-13)16(20)25-15-9-23-17(24-10-15)12-3-7-14(8-4-12)19(21)22/h1-8,15,17H,9-10H2