phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-4,5-dihydro-1,2-oxazol-4-yl]methanone

Systemtic Name: phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-4,5-dihydro-1,2-oxazol-4-yl]methanone Openeye Name: phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-4,5-dihydroisoxazol-4-yl]methanone CAS Name: phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-4,5-dihydroisoxazol-4-yl]methanone IUPAC Name: phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-4,5-dihydro-1,2-oxazol-4-yl]methanone Traditional Name: phenyl-[(4S,5S)-5-phenyl-3-(trichloromethyl)-2-isoxazolin-4-yl]methanone Formula: C17H12Cl3NO2 MolecularWeight: 368.64168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=NO2)C(Cl)(Cl)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H](C(=NO2)C(Cl)(Cl)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H12Cl3NO2/c18-17(19,20)16-13(14(22)11-7-3-1-4-8-11)15(23-21-16)12-9-5-2-6-10-12/h1-10,13,15H/t13-,15-/m1/s1