5-chloranyl-2-fluoranyl-3-[1-oxidanyl-1-(propan-2-ylamino)ethyl]benzenecarbonitrile

Systemtic Name: 5-chloranyl-2-fluoranyl-3-[1-oxidanyl-1-(propan-2-ylamino)ethyl]benzenecarbonitrile Openeye Name: 5-chloro-2-fluoro-3-[1-hydroxy-1-(isopropylamino)ethyl]benzonitrile CAS Name: 5-chloro-2-fluoro-3-[1-hydroxy-1-(propan-2-ylamino)ethyl]benzonitrile IUPAC Name: 5-chloro-2-fluoro-3-[1-hydroxy-1-(propan-2-ylamino)ethyl]benzonitrile Traditional Name: 5-chloro-2-fluoro-3-[1-hydroxy-1-(isopropylamino)ethyl]benzonitrile Formula: C12H14ClFN2O MolecularWeight: 256.703763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C)(C1=C(C(=CC(=C1)Cl)C#N)F)O

Isomeric SMILES

CC(C)NC(C)(C1=C(C(=CC(=C1)Cl)C#N)F)O

InChI

InChI=1S/C12H14ClFN2O/c1-7(2)16-12(3,17)10-5-9(13)4-8(6-15)11(10)14/h4-5,7,16-17H,1-3H3