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

Systemtic Name: (E)-3-(3-bromanyl-2-butoxy-5-chloranyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-bromo-2-butoxy-5-chloro-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-bromo-2-butoxy-5-chlorophenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-2-butoxy-5-chlorophenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-bromo-2-butoxy-5-chloro-phenyl)acrylic acid Formula: C13H14BrClO3 MolecularWeight: 333.60546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1C=CC(=O)O)Cl)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1/C=C/C(=O)O)Cl)Br

InChI

InChI=1S/C13H14BrClO3/c1-2-3-6-18-13-9(4-5-12(16)17)7-10(15)8-11(13)14/h4-5,7-8H,2-3,6H2,1H3,(H,16,17)/b5-4+