ethyl 4-(phosphonatomethyl)-1,3-thiazole-2-carboxylate

Systemtic Name: ethyl 4-(phosphonatomethyl)-1,3-thiazole-2-carboxylate Openeye Name: ethyl 4-(phosphonatomethyl)thiazole-2-carboxylate CAS Name: 4-(phosphonatomethyl)-2-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phosphonatomethyl)-1,3-thiazole-2-carboxylate Traditional Name: 4-(phosphonatomethyl)thiazole-2-carboxylic acid ethyl ester Formula: C7H8NO5PS-2 MolecularWeight: 249.180881

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CS1)CP(=O)([O-])[O-]

Isomeric SMILES

CCOC(=O)C1=NC(=CS1)CP(=O)([O-])[O-]

InChI

InChI=1S/C7H10NO5PS/c1-2-13-7(9)6-8-5(4-15-6)3-14(10,11)12/h4H,2-3H2,1H3,(H2,10,11,12)/p-2