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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNCCN(CCN1)CP(=O)(O)O)CP(=O)(O)O

Isomeric SMILES

C1CN(CCNCCN(CCN1)CP(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C10H26N4O6P2/c15-21(16,17)9-13-5-1-11-2-6-14(10-22(18,19)20)8-4-12-3-7-13/h11-12H,1-10H2,(H2,15,16,17)(H2,18,19,20)