4-(8-bromanyloctoxy)-5-methoxy-2-nitro-benzoic acid

Systemtic Name: 4-(8-bromanyloctoxy)-5-methoxy-2-nitro-benzoic acid Openeye Name: 4-(8-bromooctoxy)-5-methoxy-2-nitro-benzoic acid CAS Name: 4-(8-bromooctoxy)-5-methoxy-2-nitrobenzoic acid IUPAC Name: 4-(8-bromooctoxy)-5-methoxy-2-nitrobenzoic acid Traditional Name: 4-(8-bromooctoxy)-5-methoxy-2-nitro-benzoic acid Formula: C16H22BrNO6 MolecularWeight: 404.25298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCCCCCCCCBr

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCCCCCCCCBr

InChI

InChI=1S/C16H22BrNO6/c1-23-14-10-12(16(19)20)13(18(21)22)11-15(14)24-9-7-5-3-2-4-6-8-17/h10-11H,2-9H2,1H3,(H,19,20)