(4-tert-butylphenyl) (E)-3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoate

Systemtic Name: (4-tert-butylphenyl) (E)-3-(5-bromanyl-2-ethoxy-phenyl)prop-2-enoate Openeye Name: (4-tert-butylphenyl) (E)-3-(5-bromo-2-ethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-ethoxyphenyl)-2-propenoic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) (E)-3-(5-bromo-2-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-ethoxy-phenyl)acrylic acid (4-tert-butylphenyl) ester Formula: C21H23BrO3 MolecularWeight: 403.30952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C=CC(=O)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)/C=C/C(=O)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H23BrO3/c1-5-24-19-12-9-17(22)14-15(19)6-13-20(23)25-18-10-7-16(8-11-18)21(2,3)4/h6-14H,5H2,1-4H3/b13-6+