tert-butyl N-[3-(4-cyanophenyl)-1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[3-(4-cyanophenyl)-1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[(4-cyanophenyl)methyl]-2-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-2-oxo-ethyl]carbamate CAS Name: N-[3-(4-cyanophenyl)-1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(4-cyanophenyl)-1-(2,5-dimethyl-2,5-dihydropyrrol-1-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(4-cyanobenzyl)-2-(2,5-dimethyl-3-pyrrolin-1-yl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)C#N)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H27N3O3/c1-14-6-7-15(2)24(14)19(25)18(23-20(26)27-21(3,4)5)12-16-8-10-17(13-22)11-9-16/h6-11,14-15,18H,12H2,1-5H3,(H,23,26)