4-cyano-5-morpholin-4-yl-3-[3-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid

Systemtic Name: 4-cyano-5-morpholin-4-yl-3-[3-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid Openeye Name: 4-cyano-5-morpholino-3-[3-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid CAS Name: 4-cyano-5-(4-morpholinyl)-3-[3-(trifluoromethyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 4-cyano-5-morpholin-4-yl-3-[3-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid Traditional Name: 4-cyano-5-morpholino-3-[3-(trifluoromethyl)phenyl]-2-thenoic acid Formula: C17H13F3N2O3S MolecularWeight: 382.35693

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=C(S2)C(=O)O)C3=CC(=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

C1COCCN1C2=C(C(=C(S2)C(=O)O)C3=CC(=CC=C3)C(F)(F)F)C#N

InChI

InChI=1S/C17H13F3N2O3S/c18-17(19,20)11-3-1-2-10(8-11)13-12(9-21)15(26-14(13)16(23)24)22-4-6-25-7-5-22/h1-3,8H,4-7H2,(H,23,24)