1-ethylsulfanyl-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]propan-2-ol

Systemtic Name: 1-ethylsulfanyl-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]propan-2-ol Openeye Name: 1-ethylsulfanyl-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]propan-2-ol CAS Name: 1-(ethylthio)-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-2-propanol IUPAC Name: 1-ethylsulfanyl-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]propan-2-ol Traditional Name: 1-(ethylthio)-2-[3-methyl-5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]propan-2-ol Formula: C15H17F3N2O3S MolecularWeight: 362.36729

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(C)(C1=C(C2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])C)O

Isomeric SMILES

CCSCC(C)(C1=C(C2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])C)O

InChI

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