3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]propyl]phosphonic acid CAS Name: 3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]pentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]propyl]phosphonic acid Formula: C16H19F3NO3PS MolecularWeight: 393.360931

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(N=C(S1)C2=CC=C(C=C2)C(F)(F)F)C)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=C(N=C(S1)C2=CC=C(C=C2)C(F)(F)F)C)P(=O)(O)O

InChI

InChI=1S/C16H19F3NO3PS/c1-4-15(5-2,24(21,22)23)13-10(3)20-14(25-13)11-6-8-12(9-7-11)16(17,18)19/h6-9H,4-5H2,1-3H3,(H2,21,22,23)