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

Systemtic Name: (E)-3-(5-bromanyl-2-pentoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(5-bromo-2-pentoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(5-bromo-2-pentoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-2-pentoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(2-amoxy-5-bromo-phenyl)acrylic acid Formula: C14H17BrO3 MolecularWeight: 313.18698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Br)C=CC(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C14H17BrO3/c1-2-3-4-9-18-13-7-6-12(15)10-11(13)5-8-14(16)17/h5-8,10H,2-4,9H2,1H3,(H,16,17)/b8-5+