O2-tert-butyl O4-methyl 5-[[(5-bromanylpyridin-2-yl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-methyl 5-[[(5-bromanylpyridin-2-yl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-methyl 5-[[(5-bromo-2-pyridyl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[(5-bromo-2-pyridinyl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-methyl ester IUPAC Name: 2-O-tert-butyl 4-O-methyl 5-[[(5-bromopyridin-2-yl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[(5-bromo-2-pyridyl)amino]methyl]-3-ethyl-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-methyl ester Formula: C19H24BrN3O4 MolecularWeight: 438.31556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OC)CNC2=NC=C(C=C2)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OC)CNC2=NC=C(C=C2)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H24BrN3O4/c1-6-12-15(17(24)26-5)13(10-22-14-8-7-11(20)9-21-14)23-16(12)18(25)27-19(2,3)4/h7-9,23H,6,10H2,1-5H3,(H,21,22)