[1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid

Systemtic Name: [1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid Openeye Name: [1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid CAS Name: [1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid IUPAC Name: [1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid Traditional Name: [1-(phosphonomethyl)-1,4,7,10-tetrazacyclododec-2-yl]methylphosphonic acid Formula: C10H26N4O6P2 MolecularWeight: 360.284162

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C(CNCCN1)CP(=O)(O)O)CP(=O)(O)O

Isomeric SMILES

C1CNCCN(C(CNCCN1)CP(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C10H26N4O6P2/c15-21(16,17)8-10-7-13-4-3-11-1-2-12-5-6-14(10)9-22(18,19)20/h10-13H,1-9H2,(H2,15,16,17)(H2,18,19,20)