2-(3-bromanylpropoxycarbonyl)-5-nitro-benzoic acid

Systemtic Name: 2-(3-bromanylpropoxycarbonyl)-5-nitro-benzoic acid Openeye Name: 2-(3-bromopropoxycarbonyl)-5-nitro-benzoic acid CAS Name: 2-[3-bromopropoxy(oxo)methyl]-5-nitrobenzoic acid IUPAC Name: 2-(3-bromopropoxycarbonyl)-5-nitrobenzoic acid Traditional Name: 2-(3-bromopropoxycarbonyl)-5-nitro-benzoic acid Formula: C11H10BrNO6 MolecularWeight: 332.1042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)OCCCBr

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)OCCCBr

InChI

InChI=1S/C11H10BrNO6/c12-4-1-5-19-11(16)8-3-2-7(13(17)18)6-9(8)10(14)15/h2-3,6H,1,4-5H2,(H,14,15)