(E)-3-[4-bromanyl-2-[ethyl(2-methylpropyl)amino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-[ethyl(2-methylpropyl)amino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-[ethyl(isobutyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-[ethyl(2-methylpropyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-[ethyl(2-methylpropyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-[ethyl(isobutyl)amino]phenyl]acrylic acid Formula: C15H20BrNO2 MolecularWeight: 326.2288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(CC(C)C)C1=C(C=CC(=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C15H20BrNO2/c1-4-17(10-11(2)3)14-9-13(16)7-5-12(14)6-8-15(18)19/h5-9,11H,4,10H2,1-3H3,(H,18,19)/b8-6+