(E)-3-(5-bromanyl-2-methyl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(5-bromanyl-2-methyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(5-bromo-2-methyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-(5-bromo-2-methylphenyl)-2-propenoic acid IUPAC Name: (E)-3-(5-bromo-2-methylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(5-bromo-2-methyl-phenyl)acrylic acid Formula: C10H9BrO2 MolecularWeight: 241.08126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)C=CC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C10H9BrO2/c1-7-2-4-9(11)6-8(7)3-5-10(12)13/h2-6H,1H3,(H,12,13)/b5-3+