(E)-3-(3-bromanyl-5-methyl-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(3-bromanyl-5-methyl-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: (E)-3-(3-bromo-4-hydroxy-5-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methylphenyl)-2-propenoate IUPAC Name: (E)-3-(3-bromo-4-hydroxy-5-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methyl-phenyl)acrylate Formula: C10H8BrO3- MolecularWeight: 256.07272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C=CC(=O)[O-])Br)O

Isomeric SMILES

CC1=C(C(=CC(=C1)/C=C/C(=O)[O-])Br)O

InChI

InChI=1S/C10H9BrO3/c1-6-4-7(2-3-9(12)13)5-8(11)10(6)14/h2-5,14H,1H3,(H,12,13)/p-1/b3-2+