N-bis(3-methylphenoxy)phosphoryl-4-(trifluoromethylsulfanyl)aniline

Systemtic Name: N-bis(3-methylphenoxy)phosphoryl-4-(trifluoromethylsulfanyl)aniline Openeye Name: N-bis(3-methylphenoxy)phosphoryl-4-(trifluoromethylsulfanyl)aniline CAS Name: N-bis(3-methylphenoxy)phosphoryl-4-(trifluoromethylthio)aniline IUPAC Name: N-bis(3-methylphenoxy)phosphoryl-4-(trifluoromethylsulfanyl)aniline Traditional Name: bis(3-methylphenoxy)phosphoryl-[4-(trifluoromethylthio)phenyl]amine Formula: C21H19F3NO3PS MolecularWeight: 453.414431

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OP(=O)(NC2=CC=C(C=C2)SC(F)(F)F)OC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OP(=O)(NC2=CC=C(C=C2)SC(F)(F)F)OC3=CC=CC(=C3)C

InChI

InChI=1S/C21H19F3NO3PS/c1-15-5-3-7-18(13-15)27-29(26,28-19-8-4-6-16(2)14-19)25-17-9-11-20(12-10-17)30-21(22,23)24/h3-14H,1-2H3,(H,25,26)