methyl 4-(8-bromanyloctoxy)-5-methoxy-2-nitro-benzoate

Systemtic Name: methyl 4-(8-bromanyloctoxy)-5-methoxy-2-nitro-benzoate Openeye Name: methyl 4-(8-bromooctoxy)-5-methoxy-2-nitro-benzoate CAS Name: 4-(8-bromooctoxy)-5-methoxy-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(8-bromooctoxy)-5-methoxy-2-nitrobenzoate Traditional Name: 4-(8-bromooctoxy)-5-methoxy-2-nitro-benzoic acid methyl ester Formula: C17H24BrNO6 MolecularWeight: 418.27956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrNO6/c1-23-15-11-13(17(20)24-2)14(19(21)22)12-16(15)25-10-8-6-4-3-5-7-9-18/h11-12H,3-10H2,1-2H3