5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol

Systemtic Name: 5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Openeye Name: 5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol CAS Name: 5-[4-(trifluoromethylthio)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol IUPAC Name: 5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Traditional Name: 5-[4-(trifluoromethylthio)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol Formula: C17H16F3NO2S MolecularWeight: 355.37465

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C2=CC(=C(C=C21)O)O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

C1CNCC(C2=CC(=C(C=C21)O)O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C17H16F3NO2S/c18-17(19,20)24-12-3-1-10(2-4-12)14-9-21-6-5-11-7-15(22)16(23)8-13(11)14/h1-4,7-8,14,21-23H,5-6,9H2