[(2-ethylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid

Systemtic Name: [(2-ethylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Openeye Name: [(2-ethylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid CAS Name: [(2-ethyl-4-thiomorpholinyl)-phosphonomethyl]phosphonic acid IUPAC Name: [(2-ethylthiomorpholin-4-yl)-phosphonomethyl]phosphonic acid Traditional Name: [(2-ethylthiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Formula: C7H17NO6P2S MolecularWeight: 305.225502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCS1)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCC1CN(CCS1)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H17NO6P2S/c1-2-6-5-8(3-4-17-6)7(15(9,10)11)16(12,13)14/h6-7H,2-5H2,1H3,(H2,9,10,11)(H2,12,13,14)