[[1-[[4-(trifluoromethyl)phenyl]methoxy]naphthalen-2-yl]carbonylamino] thiane-4-carboxylate

Systemtic Name: [[1-[[4-(trifluoromethyl)phenyl]methoxy]naphthalen-2-yl]carbonylamino] thiane-4-carboxylate Openeye Name: [[1-[[4-(trifluoromethyl)phenyl]methoxy]naphthalene-2-carbonyl]amino] tetrahydrothiopyran-4-carboxylate CAS Name: 4-thianecarboxylic acid [[oxo-[1-[[4-(trifluoromethyl)phenyl]methoxy]-2-naphthalenyl]methyl]amino] ester IUPAC Name: [[1-[[4-(trifluoromethyl)phenyl]methoxy]naphthalene-2-carbonyl]amino] thiane-4-carboxylate Traditional Name: tetrahydrothiopyran-4-carboxylic acid [[1-[4-(trifluoromethyl)benzyl]oxy-2-naphthoyl]amino] ester Formula: C25H22F3NO4S MolecularWeight: 489.50669

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1C(=O)ONC(=O)C2=C(C3=CC=CC=C3C=C2)OCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CSCCC1C(=O)ONC(=O)C2=C(C3=CC=CC=C3C=C2)OCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C25H22F3NO4S/c26-25(27,28)19-8-5-16(6-9-19)15-32-22-20-4-2-1-3-17(20)7-10-21(22)23(30)29-33-24(31)18-11-13-34-14-12-18/h1-10,18H,11-15H2,(H,29,30)