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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C=CC2=C(C=CC(=C2)Br)OC)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)/C=C/C2=C(C=CC(=C2)Br)OC)C(C)(C)C

InChI

InChI=1S/C21H23BrO3/c1-14-6-9-19(17(12-14)21(2,3)4)25-20(23)11-7-15-13-16(22)8-10-18(15)24-5/h6-13H,1-5H3/b11-7+