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

Systemtic Name: 2-[1-diethoxyphosphoryl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-benzothiophene Openeye Name: 2-[1-diethoxyphosphoryl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-methyl-benzothiophene CAS Name: 2-[1-diethoxyphosphoryl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-benzothiophene IUPAC Name: 2-[1-diethoxyphosphoryl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-methyl-1-benzothiophene Traditional Name: 2-[1-diethoxyphosphoryl-2-[3-(trifluoromethyl)phenyl]ethyl]-3-methyl-benzothiophene Formula: C22H24F3O3PS MolecularWeight: 456.458131

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24F3O3PS/c1-4-27-29(26,28-5-2)19(14-16-9-8-10-17(13-16)22(23,24)25)21-15(3)18-11-6-7-12-20(18)30-21/h6-13,19H,4-5,14H2,1-3H3