2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfanyl-propan-2-ol

Systemtic Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfanyl-propan-2-ol Openeye Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfanyl-propan-2-ol CAS Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(propylthio)-2-propanol IUPAC Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-propylsulfanylpropan-2-ol Traditional Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(propylthio)propan-2-ol Formula: C15H17F3N2O3S MolecularWeight: 362.36729

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC(C)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

CCCSCC(C)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C15H17F3N2O3S/c1-3-4-24-8-14(2,21)13-6-9-5-12(20(22)23)10(15(16,17)18)7-11(9)19-13/h5-7,19,21H,3-4,8H2,1-2H3