[3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid

Systemtic Name: [3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid Openeye Name: [3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid CAS Name: [3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid IUPAC Name: [3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid Traditional Name: [3,5-dihydro-2H-1,4-thiazepin-4-yl(phosphono)methyl]phosphonic acid Formula: C6H13NO6P2S MolecularWeight: 289.183042

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC=CCN1C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CSC=CCN1C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H13NO6P2S/c8-14(9,10)6(15(11,12)13)7-2-1-4-16-5-3-7/h1,4,6H,2-3,5H2,(H2,8,9,10)(H2,11,12,13)