tert-butyl 5,12-bis(oxidanylidene)-1,4,8,11-tetrazacyclotetradecane-1-carboxylate

Systemtic Name: tert-butyl 5,12-bis(oxidanylidene)-1,4,8,11-tetrazacyclotetradecane-1-carboxylate Openeye Name: tert-butyl 5,12-dioxo-1,4,8,11-tetrazacyclotetradecane-1-carboxylate CAS Name: 5,12-dioxo-1,4,8,11-tetrazacyclotetradecane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5,12-dioxo-1,4,8,11-tetrazacyclotetradecane-1-carboxylate Traditional Name: 5,12-diketo-1,4,8,11-tetrazacyclotetradecane-1-carboxylic acid tert-butyl ester Formula: C15H28N4O4 MolecularWeight: 328.40722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=O)NCCNCCC(=O)NCC1

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(=O)NCCNCCC(=O)NCC1

InChI

InChI=1S/C15H28N4O4/c1-15(2,3)23-14(22)19-10-5-13(21)17-8-7-16-6-4-12(20)18-9-11-19/h16H,4-11H2,1-3H3,(H,17,21)(H,18,20)