(E)-3-[4-bromanyl-2-[cyclopropyl(methyl)amino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-[cyclopropyl(methyl)amino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-[cyclopropyl(methyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-[cyclopropyl(methyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-[cyclopropyl(methyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-[cyclopropyl(methyl)amino]phenyl]acrylic acid Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CC1)C2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CN(C1CC1)C2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C13H14BrNO2/c1-15(11-5-6-11)12-8-10(14)4-2-9(12)3-7-13(16)17/h2-4,7-8,11H,5-6H2,1H3,(H,16,17)/b7-3+