tert-butyl 4-methyl-2,5-dipyridin-4-yl-1H-pyrrole-3-carboxylate

Systemtic Name: tert-butyl 4-methyl-2,5-dipyridin-4-yl-1H-pyrrole-3-carboxylate Openeye Name: tert-butyl 4-methyl-2,5-bis(4-pyridyl)-1H-pyrrole-3-carboxylate CAS Name: 4-methyl-2,5-dipyridin-4-yl-1H-pyrrole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-methyl-2,5-dipyridin-4-yl-1H-pyrrole-3-carboxylate Traditional Name: 4-methyl-2,5-bis(4-pyridyl)-1H-pyrrole-3-carboxylic acid tert-butyl ester Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)(C)C)C2=CC=NC=C2)C3=CC=NC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)(C)C)C2=CC=NC=C2)C3=CC=NC=C3

InChI

InChI=1S/C20H21N3O2/c1-13-16(19(24)25-20(2,3)4)18(15-7-11-22-12-8-15)23-17(13)14-5-9-21-10-6-14/h5-12,23H,1-4H3