4-[[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]carbamoyl]quinolin-2-olate

Systemtic Name: 4-[[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]carbamoyl]quinolin-2-olate Openeye Name: 4-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]quinolin-2-olate CAS Name: 4-[oxo-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]methyl]-2-quinolinolate IUPAC Name: 4-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]quinolin-2-olate Traditional Name: 4-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]carbamoyl]quinolin-2-olate Formula: C18H9F3N3O3S- MolecularWeight: 404.34257

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)[O-])C(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)[O-])C(=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C18H10F3N3O3S/c19-18(20,21)27-9-5-6-13-14(7-9)28-17(23-13)24-16(26)11-8-15(25)22-12-4-2-1-3-10(11)12/h1-8H,(H,22,25)(H,23,24,26)/p-1