(2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid

Systemtic Name: (2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid Openeye Name: (2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid CAS Name: (2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid IUPAC Name: (2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid Traditional Name: (2-methyl-7-phosphono-1,4,5,6-tetrahydro-1,3-diazepin-7-yl)phosphonic acid Formula: C6H14N2O6P2 MolecularWeight: 272.132682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NCCCC(N1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=NCCCC(N1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H14N2O6P2/c1-5-7-4-2-3-6(8-5,15(9,10)11)16(12,13)14/h2-4H2,1H3,(H,7,8)(H2,9,10,11)(H2,12,13,14)