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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C=CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)/C=C/C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C21H23BrO3/c1-21(2,3)17-8-5-15(6-9-17)14-25-20(23)12-7-16-13-18(22)10-11-19(16)24-4/h5-13H,14H2,1-4H3/b12-7+