methyl (2S,11S)-11-acetamido-8,12-bis(oxidanylidene)-1,7-diazacyclododecane-2-carboxylate

Systemtic Name: methyl (2S,11S)-11-acetamido-8,12-bis(oxidanylidene)-1,7-diazacyclododecane-2-carboxylate Openeye Name: methyl (2S,11S)-11-acetamido-8,12-dioxo-1,7-diazacyclododecane-2-carboxylate CAS Name: (2S,11S)-11-acetamido-8,12-dioxo-1,7-diazacyclododecane-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,11S)-11-acetamido-8,12-dioxo-1,7-diazacyclododecane-2-carboxylate Traditional Name: (2S,11S)-11-acetamido-8,12-diketo-1,7-diazacyclododecane-2-carboxylic acid methyl ester Formula: C14H23N3O5 MolecularWeight: 313.34952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC(=O)NCCCCC(NC1=O)C(=O)OC

Isomeric SMILES

CC(=O)N[C@H]1CCC(=O)NCCCC[C@H](NC1=O)C(=O)OC

InChI

InChI=1S/C14H23N3O5/c1-9(18)16-10-6-7-12(19)15-8-4-3-5-11(14(21)22-2)17-13(10)20/h10-11H,3-8H2,1-2H3,(H,15,19)(H,16,18)(H,17,20)/t10-,11-/m0/s1