(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)acrylic acid Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)O)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)OC

InChI

InChI=1S/C12H13BrO4/c1-3-17-10-7-8(4-5-11(14)15)6-9(13)12(10)16-2/h4-7H,3H2,1-2H3,(H,14,15)/b5-4+