ethyl 2-[(7-bromanyl-1,3-benzodioxol-5-yl)-oxidanyl-methyl]prop-2-enoate

Systemtic Name: ethyl 2-[(7-bromanyl-1,3-benzodioxol-5-yl)-oxidanyl-methyl]prop-2-enoate Openeye Name: ethyl 2-[(7-bromo-1,3-benzodioxol-5-yl)-hydroxy-methyl]prop-2-enoate CAS Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)-hydroxymethyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-[(7-bromo-1,3-benzodioxol-5-yl)-hydroxymethyl]prop-2-enoate Traditional Name: 2-[(7-bromo-1,3-benzodioxol-5-yl)-hydroxy-methyl]acrylic acid ethyl ester Formula: C13H13BrO5 MolecularWeight: 329.14332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C(C1=CC2=C(C(=C1)Br)OCO2)O

Isomeric SMILES

CCOC(=O)C(=C)C(C1=CC2=C(C(=C1)Br)OCO2)O

InChI

InChI=1S/C13H13BrO5/c1-3-17-13(16)7(2)11(15)8-4-9(14)12-10(5-8)18-6-19-12/h4-5,11,15H,2-3,6H2,1H3