(6-bromanyl-1,3-benzodioxol-5-yl)methyl 1-methylpyrrole-2-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 1-methylpyrrole-2-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1-methylpyrrole-2-carboxylate CAS Name: 1-methyl-2-pyrrolecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 1-methylpyrrole-2-carboxylate Traditional Name: 1-methylpyrrole-2-carboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C14H12BrNO4 MolecularWeight: 338.15338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CN1C=CC=C1C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C14H12BrNO4/c1-16-4-2-3-11(16)14(17)18-7-9-5-12-13(6-10(9)15)20-8-19-12/h2-6H,7-8H2,1H3