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

Systemtic Name: O2-tert-butyl O4-(pyridin-2-ylmethyl) 3-ethyl-5-[[(4-methoxyphenyl)amino]methyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-(2-pyridylmethyl) 3-ethyl-5-[(4-methoxyanilino)methyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-ethyl-5-[(4-methoxyanilino)methyl]-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-(2-pyridinylmethyl) ester IUPAC Name: 2-O-tert-butyl 4-O-(pyridin-2-ylmethyl) 3-ethyl-5-[(4-methoxyanilino)methyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-ethyl-5-(p-anisidinomethyl)-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-(2-pyridylmethyl) ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=N2)CNC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=N2)CNC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H31N3O5/c1-6-20-22(24(30)33-16-18-9-7-8-14-27-18)21(29-23(20)25(31)34-26(2,3)4)15-28-17-10-12-19(32-5)13-11-17/h7-14,28-29H,6,15-16H2,1-5H3