2-[2-(2-bromoethyloxy)-2-oxidanylidene-ethyl]-5-nitro-benzoic acid

Systemtic Name: 2-[2-(2-bromoethyloxy)-2-oxidanylidene-ethyl]-5-nitro-benzoic acid Openeye Name: 2-[2-(2-bromoethoxy)-2-oxo-ethyl]-5-nitro-benzoic acid CAS Name: 2-[2-(2-bromoethoxy)-2-oxoethyl]-5-nitrobenzoic acid IUPAC Name: 2-[2-(2-bromoethoxy)-2-oxoethyl]-5-nitrobenzoic acid Traditional Name: 2-[2-(2-bromoethoxy)-2-keto-ethyl]-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)CC(=O)OCCBr

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrNO6/c12-3-4-19-10(14)5-7-1-2-8(13(17)18)6-9(7)11(15)16/h1-2,6H,3-5H2,(H,15,16)