[(3-methyl-2-phenyl-thiomorpholin-4-yl)-phosphono-methyl]phosphonic acid

Systemtic Name: [(3-methyl-2-phenyl-thiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Openeye Name: [(3-methyl-2-phenyl-thiomorpholin-4-yl)-phosphono-methyl]phosphonic acid CAS Name: [(3-methyl-2-phenyl-4-thiomorpholinyl)-phosphonomethyl]phosphonic acid IUPAC Name: [(3-methyl-2-phenylthiomorpholin-4-yl)-phosphonomethyl]phosphonic acid Traditional Name: [(3-methyl-2-phenyl-thiomorpholin-4-yl)-phosphono-methyl]phosphonic acid Formula: C12H19NO6P2S MolecularWeight: 367.294882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(SCCN1C(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=C2

Isomeric SMILES

CC1C(SCCN1C(P(=O)(O)O)P(=O)(O)O)C2=CC=CC=C2

InChI

InChI=1S/C12H19NO6P2S/c1-9-11(10-5-3-2-4-6-10)22-8-7-13(9)12(20(14,15)16)21(17,18)19/h2-6,9,11-12H,7-8H2,1H3,(H2,14,15,16)(H2,17,18,19)