2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphoryl-ethyl]-3-methyl-1-benzothiophene

Systemtic Name: 2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphoryl-ethyl]-3-methyl-1-benzothiophene Openeye Name: 2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphoryl-ethyl]-3-methyl-benzothiophene CAS Name: 2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphorylethyl]-3-methyl-1-benzothiophene IUPAC Name: 2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphorylethyl]-3-methyl-1-benzothiophene Traditional Name: 2-[2-[2,5-bis(trifluoromethyl)phenyl]-1-diethoxyphosphoryl-ethyl]-3-methyl-benzothiophene Formula: C23H23F6O3PS MolecularWeight: 524.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC1=C(C=CC(=C1)C(F)(F)F)C(F)(F)F)C2=C(C3=CC=CC=C3S2)C)OCC

Isomeric SMILES

CCOP(=O)(C(CC1=C(C=CC(=C1)C(F)(F)F)C(F)(F)F)C2=C(C3=CC=CC=C3S2)C)OCC

InChI

InChI=1S/C23H23F6O3PS/c1-4-31-33(30,32-5-2)19(21-14(3)17-8-6-7-9-20(17)34-21)13-15-12-16(22(24,25)26)10-11-18(15)23(27,28)29/h6-12,19H,4-5,13H2,1-3H3