(E)-3-[4-(4-bromanylbutoxy)-3-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-bromanylbutoxy)-3-methoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-bromobutoxy)-3-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(4-bromobutoxy)-3-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-bromobutoxy)-3-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-bromobutoxy)-3-methoxy-phenyl]acrylic acid Formula: C14H17BrO4 MolecularWeight: 329.18638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrO4/c1-18-13-10-11(5-7-14(16)17)4-6-12(13)19-9-3-2-8-15/h4-7,10H,2-3,8-9H2,1H3,(H,16,17)/b7-5+