(4-methoxycarbonyl-5-methyl-furan-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (4-methoxycarbonyl-5-methyl-furan-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (4-methoxycarbonyl-5-methyl-2-furyl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (4-methoxycarbonyl-5-methyl-2-furanyl)methyl ester IUPAC Name: (4-methoxycarbonyl-5-methylfuran-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (4-carbomethoxy-5-methyl-2-furyl)methyl ester Formula: C13H12BrNO5 MolecularWeight: 342.14208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2=CC(=CN2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2=CC(=CN2)Br)C(=O)OC

InChI

InChI=1S/C13H12BrNO5/c1-7-10(12(16)18-2)4-9(20-7)6-19-13(17)11-3-8(14)5-15-11/h3-5,15H,6H2,1-2H3