4-oxidanylidene-3-(phenylmethyl)-2-[4-(trifluoromethyloxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-2-[4-(trifluoromethyloxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid Openeye Name: 3-benzyl-4-oxo-2-[4-(trifluoromethoxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid CAS Name: 4-oxo-3-(phenylmethyl)-2-[4-(trifluoromethoxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid IUPAC Name: 3-benzyl-4-oxo-2-[4-(trifluoromethoxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid Traditional Name: 3-benzyl-4-keto-2-[4-(trifluoromethoxy)phenyl]imino-1,3-thiazinane-6-carboxylic acid Formula: C19H15F3N2O4S MolecularWeight: 424.39361

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=NC2=CC=C(C=C2)OC(F)(F)F)N(C1=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(SC(=NC2=CC=C(C=C2)OC(F)(F)F)N(C1=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H15F3N2O4S/c20-19(21,22)28-14-8-6-13(7-9-14)23-18-24(11-12-4-2-1-3-5-12)16(25)10-15(29-18)17(26)27/h1-9,15H,10-11H2,(H,26,27)