methyl 2-[4-(4-bromanylbutoxy)-3-methoxy-phenyl]ethanoate

Systemtic Name: methyl 2-[4-(4-bromanylbutoxy)-3-methoxy-phenyl]ethanoate Openeye Name: methyl 2-[4-(4-bromobutoxy)-3-methoxy-phenyl]acetate CAS Name: 2-[4-(4-bromobutoxy)-3-methoxyphenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromobutoxy)-3-methoxyphenyl]acetate Traditional Name: 2-[4-(4-bromobutoxy)-3-methoxy-phenyl]acetic acid methyl ester Formula: C14H19BrO4 MolecularWeight: 331.20226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)OC)OCCCCBr

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)OC)OCCCCBr

InChI

InChI=1S/C14H19BrO4/c1-17-13-9-11(10-14(16)18-2)5-6-12(13)19-8-4-3-7-15/h5-6,9H,3-4,7-8,10H2,1-2H3