(E)-3-[3-bromanyl-4-(3-cyanopropoxy)-5-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-bromanyl-4-(3-cyanopropoxy)-5-methoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-bromo-4-(3-cyanopropoxy)-5-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-bromo-4-(3-cyanopropoxy)-5-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-bromo-4-(3-cyanopropoxy)-5-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-bromo-4-(3-cyanopropoxy)-5-methoxy-phenyl]acrylic acid Formula: C14H14BrNO4 MolecularWeight: 340.16926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)O)Br)OCCCC#N

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OCCCC#N

InChI

InChI=1S/C14H14BrNO4/c1-19-12-9-10(4-5-13(17)18)8-11(15)14(12)20-7-3-2-6-16/h4-5,8-9H,2-3,7H2,1H3,(H,17,18)/b5-4+