6-[[4-(trifluoromethyl)phenyl]carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid

Systemtic Name: 6-[[4-(trifluoromethyl)phenyl]carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid Openeye Name: 6-[[4-(trifluoromethyl)phenyl]carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid CAS Name: 6-[oxo-[4-(trifluoromethyl)anilino]methyl]-2,3-dihydro-1,4-dithiin-5-carboxylic acid IUPAC Name: 6-[[4-(trifluoromethyl)phenyl]carbamoyl]-2,3-dihydro-1,4-dithiine-5-carboxylic acid Traditional Name: 6-[[4-(trifluoromethyl)phenyl]carbamoyl]-2,3-dihydro-1,4-dithiin-5-carboxylic acid Formula: C13H10F3NO3S2 MolecularWeight: 349.34861

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(S1)C(=O)NC2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CSC(=C(S1)C(=O)NC2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H10F3NO3S2/c14-13(15,16)7-1-3-8(4-2-7)17-11(18)9-10(12(19)20)22-6-5-21-9/h1-4H,5-6H2,(H,17,18)(H,19,20)