tert-butyl N-(4-oxidanylidene-5-pentyl-1,3,5-triazacyclotridecen-2-yl)carbamate

Systemtic Name: tert-butyl N-(4-oxidanylidene-5-pentyl-1,3,5-triazacyclotridecen-2-yl)carbamate Openeye Name: tert-butyl N-(4-oxo-5-pentyl-1,3,5-triazacyclotridecen-2-yl)carbamate CAS Name: N-(4-oxo-5-pentyl-1,3,5-triazacyclotridecen-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(4-oxo-5-pentyl-1,3,5-triazacyclotridecen-2-yl)carbamate Traditional Name: N-(5-amyl-4-keto-1,3,5-triazacyclotridecen-2-yl)carbamic acid tert-butyl ester Formula: C20H38N4O3 MolecularWeight: 382.54072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCCCCCCCN=C(NC1=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCN1CCCCCCCCN=C(NC1=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H38N4O3/c1-5-6-12-15-24-16-13-10-8-7-9-11-14-21-17(22-18(24)25)23-19(26)27-20(2,3)4/h5-16H2,1-4H3,(H2,21,22,23,25,26)