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9-nitro-11-oxidanylidene-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile

9-nitro-11-oxidanylidene-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile

Systemtic Name:9-nitro-11-oxidanylidene-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile
Openeye Name:9-nitro-11-oxo-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile
CAS Name:9-nitro-11-oxo-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile
IUPAC Name:9-nitro-11-oxo-2-(trifluoromethyl)-[1,3]benzothiazolo[3,2-b]isoquinoline-6-carbonitrile
Traditional Name:11-keto-9-nitro-2-(trifluoromethyl)-[1,3]benzothiazol[3,2-b]isoquinoline-6-carbonitrile
Formula: C17H6F3N3O3S
MolecularWeight: 389.30805
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N3C(=C(C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C#N)S2


Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N3C(=C(C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C#N)S2


InChI

InChI=1S/C17H6F3N3O3S/c18-17(19,20)8-1-4-14-13(5-8)22-15(24)11-6-9(23(25)26)2-3-10(11)12(7-21)16(22)27-14/h1-6H


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