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5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one

5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one

Systemtic Name:5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one
Openeye Name:5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one
CAS Name:5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one
IUPAC Name:5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one
Traditional Name:5-nitro-4-(propylamino)-7-(trifluoromethyl)-1,3-benzodithiol-2-one
Formula: C11H9F3N2O3S2
MolecularWeight: 338.32597
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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C2=C1SC(=O)S2)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

CCCNC1=C(C=C(C2=C1SC(=O)S2)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C11H9F3N2O3S2/c1-2-3-15-7-6(16(18)19)4-5(11(12,13)14)8-9(7)21-10(17)20-8/h4,15H,2-3H2,1H3


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