(E)-3-[5-bromanyl-2-[(2S)-butan-2-yl]oxy-phenyl]prop-2-enoate

Systemtic Name: (E)-3-[5-bromanyl-2-[(2S)-butan-2-yl]oxy-phenyl]prop-2-enoate Openeye Name: (E)-3-[5-bromo-2-[(1S)-1-methylpropoxy]phenyl]prop-2-enoate CAS Name: (E)-3-[5-bromo-2-[(2S)-butan-2-yl]oxyphenyl]-2-propenoate IUPAC Name: (E)-3-[5-bromo-2-[(2S)-butan-2-yl]oxyphenyl]prop-2-enoate Traditional Name: (E)-3-[5-bromo-2-[(1S)-1-methylpropoxy]phenyl]acrylate Formula: C13H14BrO3- MolecularWeight: 298.15246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)Br)C=CC(=O)[O-]

Isomeric SMILES

CC[C@H](C)OC1=C(C=C(C=C1)Br)/C=C/C(=O)[O-]

InChI

InChI=1S/C13H15BrO3/c1-3-9(2)17-12-6-5-11(14)8-10(12)4-7-13(15)16/h4-9H,3H2,1-2H3,(H,15,16)/p-1/b7-4+/t9-/m0/s1