tert-butyl N-[5-azanyl-6-(2-cyano-2,5-dihydropyrrol-1-yl)-6-oxidanylidene-hexyl]carbamate

Systemtic Name: tert-butyl N-[5-azanyl-6-(2-cyano-2,5-dihydropyrrol-1-yl)-6-oxidanylidene-hexyl]carbamate Openeye Name: tert-butyl N-[5-amino-6-(2-cyano-2,5-dihydropyrrol-1-yl)-6-oxo-hexyl]carbamate CAS Name: N-[5-amino-6-(2-cyano-2,5-dihydropyrrol-1-yl)-6-oxohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-amino-6-(2-cyano-2,5-dihydropyrrol-1-yl)-6-oxohexyl]carbamate Traditional Name: N-[5-amino-6-(2-cyano-3-pyrrolin-1-yl)-6-keto-hexyl]carbamic acid tert-butyl ester Formula: C16H26N4O3 MolecularWeight: 322.40264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(C(=O)N1CC=CC1C#N)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC(C(=O)N1CC=CC1C#N)N

InChI

InChI=1S/C16H26N4O3/c1-16(2,3)23-15(22)19-9-5-4-8-13(18)14(21)20-10-6-7-12(20)11-17/h6-7,12-13H,4-5,8-10,18H2,1-3H3,(H,19,22)