(E)-3-(5-bromanyl-2-octoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-bromanyl-2-octoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(5-bromo-2-octoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(5-bromo-2-octoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-2-octoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(5-bromo-2-octoxy-phenyl)acrylic acid Formula: C17H23BrO3 MolecularWeight: 355.26672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)Br)C=CC(=O)O

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C17H23BrO3/c1-2-3-4-5-6-7-12-21-16-10-9-15(18)13-14(16)8-11-17(19)20/h8-11,13H,2-7,12H2,1H3,(H,19,20)/b11-8+