12-azanyl-1,4,7,10-tetrazacyclotridecane-11,13-dione

Systemtic Name: 12-azanyl-1,4,7,10-tetrazacyclotridecane-11,13-dione Openeye Name: 12-amino-1,4,7,10-tetrazacyclotridecane-11,13-dione CAS Name: 12-amino-1,4,7,10-tetrazacyclotridecane-11,13-dione IUPAC Name: 12-amino-1,4,7,10-tetrazacyclotridecane-11,13-dione Traditional Name: 12-amino-1,4,7,10-tetrazacyclotridecane-11,13-quinone Formula: C9H19N5O2 MolecularWeight: 229.27946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNC(=O)C(C(=O)NCCN1)N

Isomeric SMILES

C1CNCCNC(=O)C(C(=O)NCCN1)N

InChI

InChI=1S/C9H19N5O2/c10-7-8(15)13-5-3-11-1-2-12-4-6-14-9(7)16/h7,11-12H,1-6,10H2,(H,13,15)(H,14,16)