tert-butyl 2-(4-cyanophenyl)-5-propan-2-yl-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-(4-cyanophenyl)-5-propan-2-yl-pyrrole-1-carboxylate Openeye Name: tert-butyl 2-(4-cyanophenyl)-5-isopropyl-pyrrole-1-carboxylate CAS Name: 2-(4-cyanophenyl)-5-propan-2-yl-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-cyanophenyl)-5-propan-2-ylpyrrole-1-carboxylate Traditional Name: 2-(4-cyanophenyl)-5-isopropyl-pyrrole-1-carboxylic acid tert-butyl ester Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(N1C(=O)OC(C)(C)C)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)C1=CC=C(N1C(=O)OC(C)(C)C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H22N2O2/c1-13(2)16-10-11-17(15-8-6-14(12-20)7-9-15)21(16)18(22)23-19(3,4)5/h6-11,13H,1-5H3