(E)-3-[3,5-bis(bromanyl)-4-propoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3,5-bis(bromanyl)-4-propoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-(3,5-dibromo-4-propoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3,5-dibromo-4-propoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3,5-dibromo-4-propoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3,5-dibromo-4-propoxy-phenyl)acrylic acid Formula: C12H12Br2O3 MolecularWeight: 364.02988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=CC(=O)O)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C/C(=O)O)Br

InChI

InChI=1S/C12H12Br2O3/c1-2-5-17-12-9(13)6-8(7-10(12)14)3-4-11(15)16/h3-4,6-7H,2,5H2,1H3,(H,15,16)/b4-3+