4-chloranyl-5-fluoranyl-2-[(3-oxidanyl-1-phenyl-propyl)amino]benzenecarbonitrile

Systemtic Name: 4-chloranyl-5-fluoranyl-2-[(3-oxidanyl-1-phenyl-propyl)amino]benzenecarbonitrile Openeye Name: 4-chloro-5-fluoro-2-[(3-hydroxy-1-phenyl-propyl)amino]benzonitrile CAS Name: 4-chloro-5-fluoro-2-[(3-hydroxy-1-phenylpropyl)amino]benzonitrile IUPAC Name: 4-chloro-5-fluoro-2-[(3-hydroxy-1-phenylpropyl)amino]benzonitrile Traditional Name: 4-chloro-5-fluoro-2-[(3-hydroxy-1-phenyl-propyl)amino]benzonitrile Formula: C16H14ClFN2O MolecularWeight: 304.746563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCO)NC2=CC(=C(C=C2C#N)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CCO)NC2=CC(=C(C=C2C#N)F)Cl

InChI

InChI=1S/C16H14ClFN2O/c17-13-9-16(12(10-19)8-14(13)18)20-15(6-7-21)11-4-2-1-3-5-11/h1-5,8-9,15,20-21H,6-7H2