2,3-diacetyloxy-4-oxidanylidene-4-(1,4,7,10-tetrazacyclododec-1-yl)butanoic acid

Systemtic Name: 2,3-diacetyloxy-4-oxidanylidene-4-(1,4,7,10-tetrazacyclododec-1-yl)butanoic acid Openeye Name: 2,3-diacetoxy-4-oxo-4-(1,4,7,10-tetrazacyclododec-1-yl)butanoic acid CAS Name: 2,3-diacetyloxy-4-oxo-4-(1,4,7,10-tetrazacyclododec-1-yl)butanoic acid IUPAC Name: 2,3-diacetyloxy-4-oxo-4-(1,4,7,10-tetrazacyclododec-1-yl)butanoic acid Traditional Name: 2,3-diacetoxy-4-keto-4-(1,4,7,10-tetrazacyclododec-1-yl)butyric acid Formula: C16H28N4O7 MolecularWeight: 388.41612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(C(=O)O)OC(=O)C)C(=O)N1CCNCCNCCNCC1

Isomeric SMILES

CC(=O)OC(C(C(=O)O)OC(=O)C)C(=O)N1CCNCCNCCNCC1

InChI

InChI=1S/C16H28N4O7/c1-11(21)26-13(14(16(24)25)27-12(2)22)15(23)20-9-7-18-5-3-17-4-6-19-8-10-20/h13-14,17-19H,3-10H2,1-2H3,(H,24,25)